[(6E)-2,8-bis(2,6-difluoro-4-pyridinyl)-6-isocyanoiminoindeno[1,2-b]fluoren-12-ylidene]cyanamide;[(6E)-2,8-bis(6-fluoro-3-pyridinyl)-6-isocyanoiminoindeno[1,2-b]fluoren-12-ylidene]cyanamide;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-2,8-bis(6-fluoro-3-pyridinyl)indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(6Z)-6-[cyano(isocyano)methylidene]-2-(3-methylphenyl)-8-[3-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-12-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-8-(4-methylphenyl)-2-[4-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-8-(2-methyl-4-pyridinyl)-2-[2-(trifluoromethyl)-4-pyridinyl]indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-8-(6-methyl-3-pyridinyl)-2-[6-(trifluoromethyl)-3-pyridinyl]indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;[(6E)-6-isocyanoimino-8-(4-methylphenyl)-2-[4-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-12-ylidene]cyanamide;[(12E)-12-isocyanoimino-2-(3-methylphenyl)-8-[3-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-6-ylidene]cyanamide;[(6E)-6-isocyanoimino-8-(2-methyl-4-pyridinyl)-2-[2-(trifluoromethyl)-4-pyridinyl]indeno[1,2-b]fluoren-12-ylidene]cyanamide;[(6E)-6-isocyanoimino-8-(6-methyl-3-pyridinyl)-2-[6-(trifluoromethyl)-3-pyridinyl]indeno[1,2-b]fluoren-12-ylidene]cyanamide

C396H184F32N58O4 — CID 172985383

IUPAC[(6E)-2,8-bis(2,6-difluoro-4-pyridinyl)-6-isocyanoiminoindeno[1,2-b]fluoren-12-ylidene]cyanamide;[(6E)-2,8-bis(6-fluoro-3-pyridinyl)-6-isocyanoiminoindeno[1,2-b]fluoren-12-ylidene]cyanamide;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-2,8-bis(6-fluoro-3-pyridinyl)indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(6Z)-6-[cyano(isocyano)methylidene]-2-(3-methylphenyl)-8-[3-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-12-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-8-(4-methylphenyl)-2-[4-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-8-(2-methyl-4-pyridinyl)-2-[2-(trifluoromethyl)-4-pyridinyl]indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-8-(6-methyl-3-pyridinyl)-2-[6-(trifluoromethyl)-3-pyridinyl]indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;[(6E)-6-isocyanoimino-8-(4-methylphenyl)-2-[4-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-12-ylidene]cyanamide;[(12E)-12-isocyanoimino-2-(3-methylphenyl)-8-[3-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-6-ylidene]cyanamide;[(6E)-6-isocyanoimino-8-(2-methyl-4-pyridinyl)-2-[2-(trifluoromethyl)-4-pyridinyl]indeno[1,2-b]fluoren-12-ylidene]cyanamide;[(6E)-6-isocyanoimino-8-(6-methyl-3-pyridinyl)-2-[6-(trifluoromethyl)-3-pyridinyl]indeno[1,2-b]fluoren-12-ylidene]cyanamide
SMILES[C-]#[N+]/C(C#N)=C1/c2cc(-c3ccc(C(F)(F)F)nc3)ccc2-c2cc3c(cc21)-c1ccc(-c2ccc(C)nc2)cc1/C3=C(/C#N)[N+]#[C-].[C-]#[N+]/C(C#N)=C1/c2cc(-c3ccc(F)nc3)ccc2-c2cc3c(cc21)-c1ccc(-c2ccc(F)nc2)cc1/C3=C(/C#N)[N+]#[C-].[C-]#[N+]/C(C#N)=C1/c2cc(-c3ccc(OC(F)(F)F)cc3)ccc2-c2cc3c(cc21)-c1ccc(-c2ccc(C)cc2)cc1/C3=C(/C#N)[N+]#[C-].[C-]#[N+]/C(C#N)=C1/c2cc(-c3cccc(OC(F)(F)F)c3)ccc2-c2cc3c(cc21)-c1ccc(-c2cccc(C)c2)cc1/C3=C(/C#N)[N+]#[C-].[C-]#[N+]/C(C#N)=C1/c2cc(-c3ccnc(C(F)(F)F)c3)ccc2-c2cc3c(cc21)-c1ccc(-c2ccnc(C)c2)cc1/C3=C(/C#N)[N+]#[C-].[C-]#[N+]/N=c1\c2cc(-c3cc(F)nc(F)c3)ccc2c2cc3/c(=N/C#N)c4cc(-c5cc(F)nc(F)c5)ccc4c3cc12.[C-]#[N+]/N=c1\c2cc(-c3ccc(C)cc3)ccc2c2cc3/c(=N/C#N)c4cc(-c5ccc(OC(F)(F)F)cc5)ccc4c3cc12.[C-]#[N+]/N=c1\c2cc(-c3ccc(C)nc3)ccc2c2cc3/c(=N/C#N)c4cc(-c5ccc(C(F)(F)F)nc5)ccc4c3cc12.[C-]#[N+]/N=c1\c2cc(-c3ccc(F)nc3)ccc2c2cc3/c(=N/C#N)c4cc(-c5ccc(F)nc5)ccc4c3cc12.[C-]#[N+]/N=c1\c2cc(-c3cccc(C)c3)ccc2c2cc3/c(=N/C#N)c4cc(-c5cccc(OC(F)(F)F)c5)ccc4c3cc12.[C-]#[N+]/N=c1\c2cc(-c3ccnc(C)c3)ccc2c2cc3/c(=N/C#N)c4cc(-c5ccnc(C(F)(F)F)c5)ccc4c3cc12
InChIInChI=1S/2C40H19F3N4O.2C38H17F3N6.2C36H19F3N4O.C36H14F2N6.2C34H17F3N6.C32H12F4N6.C32H14F2N6/c1-22-4-6-23(7-5-22)25-10-14-28-30-18-35-31(19-34(30)38(32(28)16-25)36(20-44)46-2)29-15-11-26(17-33(29)39(35)37(21-45)47-3)24-8-12-27(13-9-24)48-40(41,42)43;1-22-6-4-7-23(14-22)25-10-12-28-30-18-35-31(19-34(30)38(32(28)16-25)36(20-44)46-2)29-13-11-26(17-33(29)39(35)37(21-45)47-3)24-8-5-9-27(15-24)48-40(41,42)43;1-20-12-23(8-10-46-20)21-4-6-25-27-16-32-28(17-31(27)36(29(25)13-21)33(18-42)44-2)26-7-5-22(14-30(26)37(32)34(19-43)45-3)24-9-11-47-35(15-24)38(39,40)41;1-20-4-5-23(18-46-20)21-6-9-25-27-14-32-28(15-31(27)36(29(25)12-21)33(16-42)44-2)26-10-7-22(13-30(26)37(32)34(17-43)45-3)24-8-11-35(47-19-24)38(39,40)41;1-20-3-5-21(6-4-20)24-10-14-27-29-17-32-28(18-33(29)35(43-41-2)31(27)16-24)26-13-9-23(15-30(26)34(32)42-19-40)22-7-11-25(12-8-22)44-36(37,38)39;1-20-5-3-6-21(13-20)23-9-12-27-29-17-32-28(18-33(29)35(43-41-2)31(27)16-23)26-11-10-24(15-30(26)34(32)42-19-40)22-7-4-8-25(14-22)44-36(37,38)39;1-41-31(15-39)35-27-11-19(21-5-9-33(37)43-17-21)3-7-23(27)25-14-30-26(13-29(25)35)24-8-4-20(22-6-10-34(38)44-18-22)12-28(24)36(30)32(16-40)42-2;1-18-11-21(7-9-40-18)19-3-6-24-26-15-29-25(16-30(26)33(43-39-2)28(24)13-19)23-5-4-20(12-27(23)32(29)42-17-38)22-8-10-41-31(14-22)34(35,36)37;1-18-3-4-21(15-40-18)20-6-9-24-26-13-29-25(14-30(26)33(43-39-2)28(24)12-20)23-8-5-19(11-27(23)32(29)42-17-38)22-7-10-31(41-16-22)34(35,36)37;1-38-42-32-24-7-16(18-10-29(35)41-30(36)11-18)3-5-20(24)22-12-25-21(13-26(22)32)19-4-2-15(6-23(19)31(25)39-14-37)17-8-27(33)40-28(34)9-17;1-36-40-32-26-11-18(20-5-9-30(34)38-15-20)3-7-22(26)24-12-27-23(13-28(24)32)21-6-2-17(10-25(21)31(27)39-16-35)19-4-8-29(33)37-14-19/h2*4-19H,1H3;4-17H,1H3;4-15,18-19H,1H3;2*3-18H,1H3;3-14,17-18H;2*3-16H,1H3;2-13H;2-15H/b2*38-36+,39-37-;2*36-33+,37-34-;2*42-34+,43-35+;35-31-,36-32+;2*42-32+,43-33+;39-31+,42-32+;39-31+,40-32+
InChIKeyPQBHHTWGKVDCBL-AMYIVPGRSA-N
MW6426.17 g/mol
LogP95.46
Rot. Bonds26

About [(6E)-2,8-bis(2,6-difluoro-4-pyridinyl)-6-isocyanoiminoindeno[1,2-b]fluoren-12-ylidene]cyanamide;[(6E)-2,8-bis(6-fluoro-3-pyridinyl)-6-isocyanoiminoindeno[1,2-b]fluoren-12-ylidene]cyanamide;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-2,8-bis(6-fluoro-3-pyridinyl)indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(6Z)-6-[cyano(isocyano)methylidene]-2-(3-methylphenyl)-8-[3-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-12-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-8-(4-methylphenyl)-2-[4-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-8-(2-methyl-4-pyridinyl)-2-[2-(trifluoromethyl)-4-pyridinyl]indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-8-(6-methyl-3-pyridinyl)-2-[6-(trifluoromethyl)-3-pyridinyl]indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;[(6E)-6-isocyanoimino-8-(4-methylphenyl)-2-[4-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-12-ylidene]cyanamide;[(12E)-12-isocyanoimino-2-(3-methylphenyl)-8-[3-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-6-ylidene]cyanamide;[(6E)-6-isocyanoimino-8-(2-methyl-4-pyridinyl)-2-[2-(trifluoromethyl)-4-pyridinyl]indeno[1,2-b]fluoren-12-ylidene]cyanamide;[(6E)-6-isocyanoimino-8-(6-methyl-3-pyridinyl)-2-[6-(trifluoromethyl)-3-pyridinyl]indeno[1,2-b]fluoren-12-ylidene]cyanamide

[(6E)-2,8-bis(2,6-difluoro-4-pyridinyl)-6-isocyanoiminoindeno[1,2-b]fluoren-12-ylidene]cyanamide;[(6E)-2,8-bis(6-fluoro-3-pyridinyl)-6-isocyanoiminoindeno[1,2-b]fluoren-12-ylidene]cyanamide;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-2,8-bis(6-fluoro-3-pyridinyl)indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(6Z)-6-[cyano(isocyano)methylidene]-2-(3-methylphenyl)-8-[3-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-12-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-8-(4-methylphenyl)-2-[4-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-8-(2-methyl-4-pyridinyl)-2-[2-(trifluoromethyl)-4-pyridinyl]indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-8-(6-methyl-3-pyridinyl)-2-[6-(trifluoromethyl)-3-pyridinyl]indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;[(6E)-6-isocyanoimino-8-(4-methylphenyl)-2-[4-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-12-ylidene]cyanamide;[(12E)-12-isocyanoimino-2-(3-methylphenyl)-8-[3-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-6-ylidene]cyanamide;[(6E)-6-isocyanoimino-8-(2-methyl-4-pyridinyl)-2-[2-(trifluoromethyl)-4-pyridinyl]indeno[1,2-b]fluoren-12-ylidene]cyanamide;[(6E)-6-isocyanoimino-8-(6-methyl-3-pyridinyl)-2-[6-(trifluoromethyl)-3-pyridinyl]indeno[1,2-b]fluoren-12-ylidene]cyanamide (PubChem CID 172985383) has the molecular formula C396H184F32N58O4 and a molecular weight of 6426.17 g/mol. Its IUPAC name is [(6E)-2,8-bis(2,6-difluoro-4-pyridinyl)-6-isocyanoiminoindeno[1,2-b]fluoren-12-ylidene]cyanamide;[(6E)-2,8-bis(6-fluoro-3-pyridinyl)-6-isocyanoiminoindeno[1,2-b]fluoren-12-ylidene]cyanamide;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-2,8-bis(6-fluoro-3-pyridinyl)indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(6Z)-6-[cyano(isocyano)methylidene]-2-(3-methylphenyl)-8-[3-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-12-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-8-(4-methylphenyl)-2-[4-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-8-(2-methyl-4-pyridinyl)-2-[2-(trifluoromethyl)-4-pyridinyl]indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-8-(6-methyl-3-pyridinyl)-2-[6-(trifluoromethyl)-3-pyridinyl]indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;[(6E)-6-isocyanoimino-8-(4-methylphenyl)-2-[4-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-12-ylidene]cyanamide;[(12E)-12-isocyanoimino-2-(3-methylphenyl)-8-[3-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-6-ylidene]cyanamide;[(6E)-6-isocyanoimino-8-(2-methyl-4-pyridinyl)-2-[2-(trifluoromethyl)-4-pyridinyl]indeno[1,2-b]fluoren-12-ylidene]cyanamide;[(6E)-6-isocyanoimino-8-(6-methyl-3-pyridinyl)-2-[6-(trifluoromethyl)-3-pyridinyl]indeno[1,2-b]fluoren-12-ylidene]cyanamide.

Molecular Properties

Compound Name[(6E)-2,8-bis(2,6-difluoro-4-pyridinyl)-6-isocyanoiminoindeno[1,2-b]fluoren-12-ylidene]cyanamide;[(6E)-2,8-bis(6-fluoro-3-pyridinyl)-6-isocyanoiminoindeno[1,2-b]fluoren-12-ylidene]cyanamide;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-2,8-bis(6-fluoro-3-pyridinyl)indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(6Z)-6-[cyano(isocyano)methylidene]-2-(3-methylphenyl)-8-[3-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-12-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-8-(4-methylphenyl)-2-[4-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-8-(2-methyl-4-pyridinyl)-2-[2-(trifluoromethyl)-4-pyridinyl]indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-8-(6-methyl-3-pyridinyl)-2-[6-(trifluoromethyl)-3-pyridinyl]indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;[(6E)-6-isocyanoimino-8-(4-methylphenyl)-2-[4-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-12-ylidene]cyanamide;[(12E)-12-isocyanoimino-2-(3-methylphenyl)-8-[3-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-6-ylidene]cyanamide;[(6E)-6-isocyanoimino-8-(2-methyl-4-pyridinyl)-2-[2-(trifluoromethyl)-4-pyridinyl]indeno[1,2-b]fluoren-12-ylidene]cyanamide;[(6E)-6-isocyanoimino-8-(6-methyl-3-pyridinyl)-2-[6-(trifluoromethyl)-3-pyridinyl]indeno[1,2-b]fluoren-12-ylidene]cyanamide
PubChem CID172985383
Molecular FormulaC396H184F32N58O4
Molecular Weight6426.17 g/mol
Exact Mass6421.55
IUPAC Name[(6E)-2,8-bis(2,6-difluoro-4-pyridinyl)-6-isocyanoiminoindeno[1,2-b]fluoren-12-ylidene]cyanamide;[(6E)-2,8-bis(6-fluoro-3-pyridinyl)-6-isocyanoiminoindeno[1,2-b]fluoren-12-ylidene]cyanamide;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-2,8-bis(6-fluoro-3-pyridinyl)indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(6Z)-6-[cyano(isocyano)methylidene]-2-(3-methylphenyl)-8-[3-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-12-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-8-(4-methylphenyl)-2-[4-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-8-(2-methyl-4-pyridinyl)-2-[2-(trifluoromethyl)-4-pyridinyl]indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-8-(6-methyl-3-pyridinyl)-2-[6-(trifluoromethyl)-3-pyridinyl]indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;[(6E)-6-isocyanoimino-8-(4-methylphenyl)-2-[4-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-12-ylidene]cyanamide;[(12E)-12-isocyanoimino-2-(3-methylphenyl)-8-[3-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-6-ylidene]cyanamide;[(6E)-6-isocyanoimino-8-(2-methyl-4-pyridinyl)-2-[2-(trifluoromethyl)-4-pyridinyl]indeno[1,2-b]fluoren-12-ylidene]cyanamide;[(6E)-6-isocyanoimino-8-(6-methyl-3-pyridinyl)-2-[6-(trifluoromethyl)-3-pyridinyl]indeno[1,2-b]fluoren-12-ylidene]cyanamide
SMILES[C-]#[N+]/C(C#N)=C1/c2cc(-c3ccc(C(F)(F)F)nc3)ccc2-c2cc3c(cc21)-c1ccc(-c2ccc(C)nc2)cc1/C3=C(/C#N)[N+]#[C-].[C-]#[N+]/C(C#N)=C1/c2cc(-c3ccc(F)nc3)ccc2-c2cc3c(cc21)-c1ccc(-c2ccc(F)nc2)cc1/C3=C(/C#N)[N+]#[C-].[C-]#[N+]/C(C#N)=C1/c2cc(-c3ccc(OC(F)(F)F)cc3)ccc2-c2cc3c(cc21)-c1ccc(-c2ccc(C)cc2)cc1/C3=C(/C#N)[N+]#[C-].[C-]#[N+]/C(C#N)=C1/c2cc(-c3cccc(OC(F)(F)F)c3)ccc2-c2cc3c(cc21)-c1ccc(-c2cccc(C)c2)cc1/C3=C(/C#N)[N+]#[C-].[C-]#[N+]/C(C#N)=C1/c2cc(-c3ccnc(C(F)(F)F)c3)ccc2-c2cc3c(cc21)-c1ccc(-c2ccnc(C)c2)cc1/C3=C(/C#N)[N+]#[C-].[C-]#[N+]/N=c1\c2cc(-c3cc(F)nc(F)c3)ccc2c2cc3/c(=N/C#N)c4cc(-c5cc(F)nc(F)c5)ccc4c3cc12.[C-]#[N+]/N=c1\c2cc(-c3ccc(C)cc3)ccc2c2cc3/c(=N/C#N)c4cc(-c5ccc(OC(F)(F)F)cc5)ccc4c3cc12.[C-]#[N+]/N=c1\c2cc(-c3ccc(C)nc3)ccc2c2cc3/c(=N/C#N)c4cc(-c5ccc(C(F)(F)F)nc5)ccc4c3cc12.[C-]#[N+]/N=c1\c2cc(-c3ccc(F)nc3)ccc2c2cc3/c(=N/C#N)c4cc(-c5ccc(F)nc5)ccc4c3cc12.[C-]#[N+]/N=c1\c2cc(-c3cccc(C)c3)ccc2c2cc3/c(=N/C#N)c4cc(-c5cccc(OC(F)(F)F)c5)ccc4c3cc12.[C-]#[N+]/N=c1\c2cc(-c3ccnc(C)c3)ccc2c2cc3/c(=N/C#N)c4cc(-c5ccnc(C(F)(F)F)c5)ccc4c3cc12
InChIInChI=1S/2C40H19F3N4O.2C38H17F3N6.2C36H19F3N4O.C36H14F2N6.2C34H17F3N6.C32H12F4N6.C32H14F2N6/c1-22-4-6-23(7-5-22)25-10-14-28-30-18-35-31(19-34(30)38(32(28)16-25)36(20-44)46-2)29-15-11-26(17-33(29)39(35)37(21-45)47-3)24-8-12-27(13-9-24)48-40(41,42)43;1-22-6-4-7-23(14-22)25-10-12-28-30-18-35-31(19-34(30)38(32(28)16-25)36(20-44)46-2)29-13-11-26(17-33(29)39(35)37(21-45)47-3)24-8-5-9-27(15-24)48-40(41,42)43;1-20-12-23(8-10-46-20)21-4-6-25-27-16-32-28(17-31(27)36(29(25)13-21)33(18-42)44-2)26-7-5-22(14-30(26)37(32)34(19-43)45-3)24-9-11-47-35(15-24)38(39,40)41;1-20-4-5-23(18-46-20)21-6-9-25-27-14-32-28(15-31(27)36(29(25)12-21)33(16-42)44-2)26-10-7-22(13-30(26)37(32)34(17-43)45-3)24-8-11-35(47-19-24)38(39,40)41;1-20-3-5-21(6-4-20)24-10-14-27-29-17-32-28(18-33(29)35(43-41-2)31(27)16-24)26-13-9-23(15-30(26)34(32)42-19-40)22-7-11-25(12-8-22)44-36(37,38)39;1-20-5-3-6-21(13-20)23-9-12-27-29-17-32-28(18-33(29)35(43-41-2)31(27)16-23)26-11-10-24(15-30(26)34(32)42-19-40)22-7-4-8-25(14-22)44-36(37,38)39;1-41-31(15-39)35-27-11-19(21-5-9-33(37)43-17-21)3-7-23(27)25-14-30-26(13-29(25)35)24-8-4-20(22-6-10-34(38)44-18-22)12-28(24)36(30)32(16-40)42-2;1-18-11-21(7-9-40-18)19-3-6-24-26-15-29-25(16-30(26)33(43-39-2)28(24)13-19)23-5-4-20(12-27(23)32(29)42-17-38)22-8-10-41-31(14-22)34(35,36)37;1-18-3-4-21(15-40-18)20-6-9-24-26-13-29-25(14-30(26)33(43-39-2)28(24)12-20)23-8-5-19(11-27(23)32(29)42-17-38)22-7-10-31(41-16-22)34(35,36)37;1-38-42-32-24-7-16(18-10-29(35)41-30(36)11-18)3-5-20(24)22-12-25-21(13-26(22)32)19-4-2-15(6-23(19)31(25)39-14-37)17-8-27(33)40-28(34)9-17;1-36-40-32-26-11-18(20-5-9-30(34)38-15-20)3-7-22(26)24-12-27-23(13-28(24)32)21-6-2-17(10-25(21)31(27)39-16-35)19-4-8-29(33)37-14-19/h2*4-19H,1H3;4-17H,1H3;4-15,18-19H,1H3;2*3-18H,1H3;3-14,17-18H;2*3-16H,1H3;2-13H;2-15H/b2*38-36+,39-37-;2*36-33+,37-34-;2*42-34+,43-35+;35-31-,36-32+;2*42-32+,43-33+;39-31+,42-32+;39-31+,40-32+
InChIKeyPQBHHTWGKVDCBL-AMYIVPGRSA-N
XLogP95.46
TPSA816.10 Ų
H-Bond Donors
H-Bond Acceptors46
Rotatable Bonds26
Heavy Atoms490
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5006426.17
LogP ≤ 595.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1046

Analyze [(6E)-2,8-bis(2,6-difluoro-4-pyridinyl)-6-isocyanoiminoindeno[1,2-b]fluoren-12-ylidene]cyanamide;[(6E)-2,8-bis(6-fluoro-3-pyridinyl)-6-isocyanoiminoindeno[1,2-b]fluoren-12-ylidene]cyanamide;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-2,8-bis(6-fluoro-3-pyridinyl)indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(6Z)-6-[cyano(isocyano)methylidene]-2-(3-methylphenyl)-8-[3-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-12-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-8-(4-methylphenyl)-2-[4-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-8-(2-methyl-4-pyridinyl)-2-[2-(trifluoromethyl)-4-pyridinyl]indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-8-(6-methyl-3-pyridinyl)-2-[6-(trifluoromethyl)-3-pyridinyl]indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;[(6E)-6-isocyanoimino-8-(4-methylphenyl)-2-[4-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-12-ylidene]cyanamide;[(12E)-12-isocyanoimino-2-(3-methylphenyl)-8-[3-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-6-ylidene]cyanamide;[(6E)-6-isocyanoimino-8-(2-methyl-4-pyridinyl)-2-[2-(trifluoromethyl)-4-pyridinyl]indeno[1,2-b]fluoren-12-ylidene]cyanamide;[(6E)-6-isocyanoimino-8-(6-methyl-3-pyridinyl)-2-[6-(trifluoromethyl)-3-pyridinyl]indeno[1,2-b]fluoren-12-ylidene]cyanamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of [(6E)-2,8-bis(2,6-difluoro-4-pyridinyl)-6-isocyanoiminoindeno[1,2-b]fluoren-12-ylidene]cyanamide;[(6E)-2,8-bis(6-fluoro-3-pyridinyl)-6-isocyanoiminoindeno[1,2-b]fluoren-12-ylidene]cyanamide;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-2,8-bis(6-fluoro-3-pyridinyl)indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(6Z)-6-[cyano(isocyano)methylidene]-2-(3-methylphenyl)-8-[3-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-12-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-8-(4-methylphenyl)-2-[4-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-8-(2-methyl-4-pyridinyl)-2-[2-(trifluoromethyl)-4-pyridinyl]indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-8-(6-methyl-3-pyridinyl)-2-[6-(trifluoromethyl)-3-pyridinyl]indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;[(6E)-6-isocyanoimino-8-(4-methylphenyl)-2-[4-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-12-ylidene]cyanamide;[(12E)-12-isocyanoimino-2-(3-methylphenyl)-8-[3-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-6-ylidene]cyanamide;[(6E)-6-isocyanoimino-8-(2-methyl-4-pyridinyl)-2-[2-(trifluoromethyl)-4-pyridinyl]indeno[1,2-b]fluoren-12-ylidene]cyanamide;[(6E)-6-isocyanoimino-8-(6-methyl-3-pyridinyl)-2-[6-(trifluoromethyl)-3-pyridinyl]indeno[1,2-b]fluoren-12-ylidene]cyanamide?
The IUPAC name of [(6E)-2,8-bis(2,6-difluoro-4-pyridinyl)-6-isocyanoiminoindeno[1,2-b]fluoren-12-ylidene]cyanamide;[(6E)-2,8-bis(6-fluoro-3-pyridinyl)-6-isocyanoiminoindeno[1,2-b]fluoren-12-ylidene]cyanamide;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-2,8-bis(6-fluoro-3-pyridinyl)indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(6Z)-6-[cyano(isocyano)methylidene]-2-(3-methylphenyl)-8-[3-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-12-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-8-(4-methylphenyl)-2-[4-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-8-(2-methyl-4-pyridinyl)-2-[2-(trifluoromethyl)-4-pyridinyl]indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-8-(6-methyl-3-pyridinyl)-2-[6-(trifluoromethyl)-3-pyridinyl]indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;[(6E)-6-isocyanoimino-8-(4-methylphenyl)-2-[4-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-12-ylidene]cyanamide;[(12E)-12-isocyanoimino-2-(3-methylphenyl)-8-[3-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-6-ylidene]cyanamide;[(6E)-6-isocyanoimino-8-(2-methyl-4-pyridinyl)-2-[2-(trifluoromethyl)-4-pyridinyl]indeno[1,2-b]fluoren-12-ylidene]cyanamide;[(6E)-6-isocyanoimino-8-(6-methyl-3-pyridinyl)-2-[6-(trifluoromethyl)-3-pyridinyl]indeno[1,2-b]fluoren-12-ylidene]cyanamide (CID 172985383) is [(6E)-2,8-bis(2,6-difluoro-4-pyridinyl)-6-isocyanoiminoindeno[1,2-b]fluoren-12-ylidene]cyanamide;[(6E)-2,8-bis(6-fluoro-3-pyridinyl)-6-isocyanoiminoindeno[1,2-b]fluoren-12-ylidene]cyanamide;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-2,8-bis(6-fluoro-3-pyridinyl)indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(6Z)-6-[cyano(isocyano)methylidene]-2-(3-methylphenyl)-8-[3-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-12-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-8-(4-methylphenyl)-2-[4-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-8-(2-methyl-4-pyridinyl)-2-[2-(trifluoromethyl)-4-pyridinyl]indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-8-(6-methyl-3-pyridinyl)-2-[6-(trifluoromethyl)-3-pyridinyl]indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;[(6E)-6-isocyanoimino-8-(4-methylphenyl)-2-[4-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-12-ylidene]cyanamide;[(12E)-12-isocyanoimino-2-(3-methylphenyl)-8-[3-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-6-ylidene]cyanamide;[(6E)-6-isocyanoimino-8-(2-methyl-4-pyridinyl)-2-[2-(trifluoromethyl)-4-pyridinyl]indeno[1,2-b]fluoren-12-ylidene]cyanamide;[(6E)-6-isocyanoimino-8-(6-methyl-3-pyridinyl)-2-[6-(trifluoromethyl)-3-pyridinyl]indeno[1,2-b]fluoren-12-ylidene]cyanamide.
What is the SMILES notation for [(6E)-2,8-bis(2,6-difluoro-4-pyridinyl)-6-isocyanoiminoindeno[1,2-b]fluoren-12-ylidene]cyanamide;[(6E)-2,8-bis(6-fluoro-3-pyridinyl)-6-isocyanoiminoindeno[1,2-b]fluoren-12-ylidene]cyanamide;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-2,8-bis(6-fluoro-3-pyridinyl)indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(6Z)-6-[cyano(isocyano)methylidene]-2-(3-methylphenyl)-8-[3-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-12-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-8-(4-methylphenyl)-2-[4-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-8-(2-methyl-4-pyridinyl)-2-[2-(trifluoromethyl)-4-pyridinyl]indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-8-(6-methyl-3-pyridinyl)-2-[6-(trifluoromethyl)-3-pyridinyl]indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;[(6E)-6-isocyanoimino-8-(4-methylphenyl)-2-[4-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-12-ylidene]cyanamide;[(12E)-12-isocyanoimino-2-(3-methylphenyl)-8-[3-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-6-ylidene]cyanamide;[(6E)-6-isocyanoimino-8-(2-methyl-4-pyridinyl)-2-[2-(trifluoromethyl)-4-pyridinyl]indeno[1,2-b]fluoren-12-ylidene]cyanamide;[(6E)-6-isocyanoimino-8-(6-methyl-3-pyridinyl)-2-[6-(trifluoromethyl)-3-pyridinyl]indeno[1,2-b]fluoren-12-ylidene]cyanamide?
The canonical SMILES for [(6E)-2,8-bis(2,6-difluoro-4-pyridinyl)-6-isocyanoiminoindeno[1,2-b]fluoren-12-ylidene]cyanamide;[(6E)-2,8-bis(6-fluoro-3-pyridinyl)-6-isocyanoiminoindeno[1,2-b]fluoren-12-ylidene]cyanamide;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-2,8-bis(6-fluoro-3-pyridinyl)indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(6Z)-6-[cyano(isocyano)methylidene]-2-(3-methylphenyl)-8-[3-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-12-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-8-(4-methylphenyl)-2-[4-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-8-(2-methyl-4-pyridinyl)-2-[2-(trifluoromethyl)-4-pyridinyl]indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-8-(6-methyl-3-pyridinyl)-2-[6-(trifluoromethyl)-3-pyridinyl]indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;[(6E)-6-isocyanoimino-8-(4-methylphenyl)-2-[4-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-12-ylidene]cyanamide;[(12E)-12-isocyanoimino-2-(3-methylphenyl)-8-[3-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-6-ylidene]cyanamide;[(6E)-6-isocyanoimino-8-(2-methyl-4-pyridinyl)-2-[2-(trifluoromethyl)-4-pyridinyl]indeno[1,2-b]fluoren-12-ylidene]cyanamide;[(6E)-6-isocyanoimino-8-(6-methyl-3-pyridinyl)-2-[6-(trifluoromethyl)-3-pyridinyl]indeno[1,2-b]fluoren-12-ylidene]cyanamide is [C-]#[N+]/C(C#N)=C1/c2cc(-c3ccc(C(F)(F)F)nc3)ccc2-c2cc3c(cc21)-c1ccc(-c2ccc(C)nc2)cc1/C3=C(/C#N)[N+]#[C-].[C-]#[N+]/C(C#N)=C1/c2cc(-c3ccc(F)nc3)ccc2-c2cc3c(cc21)-c1ccc(-c2ccc(F)nc2)cc1/C3=C(/C#N)[N+]#[C-].[C-]#[N+]/C(C#N)=C1/c2cc(-c3ccc(OC(F)(F)F)cc3)ccc2-c2cc3c(cc21)-c1ccc(-c2ccc(C)cc2)cc1/C3=C(/C#N)[N+]#[C-].[C-]#[N+]/C(C#N)=C1/c2cc(-c3cccc(OC(F)(F)F)c3)ccc2-c2cc3c(cc21)-c1ccc(-c2cccc(C)c2)cc1/C3=C(/C#N)[N+]#[C-].[C-]#[N+]/C(C#N)=C1/c2cc(-c3ccnc(C(F)(F)F)c3)ccc2-c2cc3c(cc21)-c1ccc(-c2ccnc(C)c2)cc1/C3=C(/C#N)[N+]#[C-].[C-]#[N+]/N=c1\c2cc(-c3cc(F)nc(F)c3)ccc2c2cc3/c(=N/C#N)c4cc(-c5cc(F)nc(F)c5)ccc4c3cc12.[C-]#[N+]/N=c1\c2cc(-c3ccc(C)cc3)ccc2c2cc3/c(=N/C#N)c4cc(-c5ccc(OC(F)(F)F)cc5)ccc4c3cc12.[C-]#[N+]/N=c1\c2cc(-c3ccc(C)nc3)ccc2c2cc3/c(=N/C#N)c4cc(-c5ccc(C(F)(F)F)nc5)ccc4c3cc12.[C-]#[N+]/N=c1\c2cc(-c3ccc(F)nc3)ccc2c2cc3/c(=N/C#N)c4cc(-c5ccc(F)nc5)ccc4c3cc12.[C-]#[N+]/N=c1\c2cc(-c3cccc(C)c3)ccc2c2cc3/c(=N/C#N)c4cc(-c5cccc(OC(F)(F)F)c5)ccc4c3cc12.[C-]#[N+]/N=c1\c2cc(-c3ccnc(C)c3)ccc2c2cc3/c(=N/C#N)c4cc(-c5ccnc(C(F)(F)F)c5)ccc4c3cc12.
What is the InChIKey of [(6E)-2,8-bis(2,6-difluoro-4-pyridinyl)-6-isocyanoiminoindeno[1,2-b]fluoren-12-ylidene]cyanamide;[(6E)-2,8-bis(6-fluoro-3-pyridinyl)-6-isocyanoiminoindeno[1,2-b]fluoren-12-ylidene]cyanamide;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-2,8-bis(6-fluoro-3-pyridinyl)indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(6Z)-6-[cyano(isocyano)methylidene]-2-(3-methylphenyl)-8-[3-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-12-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-8-(4-methylphenyl)-2-[4-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-8-(2-methyl-4-pyridinyl)-2-[2-(trifluoromethyl)-4-pyridinyl]indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-8-(6-methyl-3-pyridinyl)-2-[6-(trifluoromethyl)-3-pyridinyl]indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;[(6E)-6-isocyanoimino-8-(4-methylphenyl)-2-[4-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-12-ylidene]cyanamide;[(12E)-12-isocyanoimino-2-(3-methylphenyl)-8-[3-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-6-ylidene]cyanamide;[(6E)-6-isocyanoimino-8-(2-methyl-4-pyridinyl)-2-[2-(trifluoromethyl)-4-pyridinyl]indeno[1,2-b]fluoren-12-ylidene]cyanamide;[(6E)-6-isocyanoimino-8-(6-methyl-3-pyridinyl)-2-[6-(trifluoromethyl)-3-pyridinyl]indeno[1,2-b]fluoren-12-ylidene]cyanamide?
The InChIKey is PQBHHTWGKVDCBL-AMYIVPGRSA-N. The full InChI is InChI=1S/2C40H19F3N4O.2C38H17F3N6.2C36H19F3N4O.C36H14F2N6.2C34H17F3N6.C32H12F4N6.C32H14F2N6/c1-22-4-6-23(7-5-22)25-10-14-28-30-18-35-31(19-34(30)38(32(28)16-25)36(20-44)46-2)29-15-11-26(17-33(29)39(35)37(21-45)47-3)24-8-12-27(13-9-24)48-40(41,42)43;1-22-6-4-7-23(14-22)25-10-12-28-30-18-35-31(19-34(30)38(32(28)16-25)36(20-44)46-2)29-13-11-26(17-33(29)39(35)37(21-45)47-3)24-8-5-9-27(15-24)48-40(41,42)43;1-20-12-23(8-10-46-20)21-4-6-25-27-16-32-28(17-31(27)36(29(25)13-21)33(18-42)44-2)26-7-5-22(14-30(26)37(32)34(19-43)45-3)24-9-11-47-35(15-24)38(39,40)41;1-20-4-5-23(18-46-20)21-6-9-25-27-14-32-28(15-31(27)36(29(25)12-21)33(16-42)44-2)26-10-7-22(13-30(26)37(32)34(17-43)45-3)24-8-11-35(47-19-24)38(39,40)41;1-20-3-5-21(6-4-20)24-10-14-27-29-17-32-28(18-33(29)35(43-41-2)31(27)16-24)26-13-9-23(15-30(26)34(32)42-19-40)22-7-11-25(12-8-22)44-36(37,38)39;1-20-5-3-6-21(13-20)23-9-12-27-29-17-32-28(18-33(29)35(43-41-2)31(27)16-23)26-11-10-24(15-30(26)34(32)42-19-40)22-7-4-8-25(14-22)44-36(37,38)39;1-41-31(15-39)35-27-11-19(21-5-9-33(37)43-17-21)3-7-23(27)25-14-30-26(13-29(25)35)24-8-4-20(22-6-10-34(38)44-18-22)12-28(24)36(30)32(16-40)42-2;1-18-11-21(7-9-40-18)19-3-6-24-26-15-29-25(16-30(26)33(43-39-2)28(24)13-19)23-5-4-20(12-27(23)32(29)42-17-38)22-8-10-41-31(14-22)34(35,36)37;1-18-3-4-21(15-40-18)20-6-9-24-26-13-29-25(14-30(26)33(43-39-2)28(24)12-20)23-8-5-19(11-27(23)32(29)42-17-38)22-7-10-31(41-16-22)34(35,36)37;1-38-42-32-24-7-16(18-10-29(35)41-30(36)11-18)3-5-20(24)22-12-25-21(13-26(22)32)19-4-2-15(6-23(19)31(25)39-14-37)17-8-27(33)40-28(34)9-17;1-36-40-32-26-11-18(20-5-9-30(34)38-15-20)3-7-22(26)24-12-27-23(13-28(24)32)21-6-2-17(10-25(21)31(27)39-16-35)19-4-8-29(33)37-14-19/h2*4-19H,1H3;4-17H,1H3;4-15,18-19H,1H3;2*3-18H,1H3;3-14,17-18H;2*3-16H,1H3;2-13H;2-15H/b2*38-36+,39-37-;2*36-33+,37-34-;2*42-34+,43-35+;35-31-,36-32+;2*42-32+,43-33+;39-31+,42-32+;39-31+,40-32+.
What are the key properties of [(6E)-2,8-bis(2,6-difluoro-4-pyridinyl)-6-isocyanoiminoindeno[1,2-b]fluoren-12-ylidene]cyanamide;[(6E)-2,8-bis(6-fluoro-3-pyridinyl)-6-isocyanoiminoindeno[1,2-b]fluoren-12-ylidene]cyanamide;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-2,8-bis(6-fluoro-3-pyridinyl)indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(6Z)-6-[cyano(isocyano)methylidene]-2-(3-methylphenyl)-8-[3-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-12-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-8-(4-methylphenyl)-2-[4-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-8-(2-methyl-4-pyridinyl)-2-[2-(trifluoromethyl)-4-pyridinyl]indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-8-(6-methyl-3-pyridinyl)-2-[6-(trifluoromethyl)-3-pyridinyl]indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;[(6E)-6-isocyanoimino-8-(4-methylphenyl)-2-[4-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-12-ylidene]cyanamide;[(12E)-12-isocyanoimino-2-(3-methylphenyl)-8-[3-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-6-ylidene]cyanamide;[(6E)-6-isocyanoimino-8-(2-methyl-4-pyridinyl)-2-[2-(trifluoromethyl)-4-pyridinyl]indeno[1,2-b]fluoren-12-ylidene]cyanamide;[(6E)-6-isocyanoimino-8-(6-methyl-3-pyridinyl)-2-[6-(trifluoromethyl)-3-pyridinyl]indeno[1,2-b]fluoren-12-ylidene]cyanamide?
[(6E)-2,8-bis(2,6-difluoro-4-pyridinyl)-6-isocyanoiminoindeno[1,2-b]fluoren-12-ylidene]cyanamide;[(6E)-2,8-bis(6-fluoro-3-pyridinyl)-6-isocyanoiminoindeno[1,2-b]fluoren-12-ylidene]cyanamide;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-2,8-bis(6-fluoro-3-pyridinyl)indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(6Z)-6-[cyano(isocyano)methylidene]-2-(3-methylphenyl)-8-[3-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-12-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-8-(4-methylphenyl)-2-[4-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-8-(2-methyl-4-pyridinyl)-2-[2-(trifluoromethyl)-4-pyridinyl]indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-8-(6-methyl-3-pyridinyl)-2-[6-(trifluoromethyl)-3-pyridinyl]indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;[(6E)-6-isocyanoimino-8-(4-methylphenyl)-2-[4-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-12-ylidene]cyanamide;[(12E)-12-isocyanoimino-2-(3-methylphenyl)-8-[3-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-6-ylidene]cyanamide;[(6E)-6-isocyanoimino-8-(2-methyl-4-pyridinyl)-2-[2-(trifluoromethyl)-4-pyridinyl]indeno[1,2-b]fluoren-12-ylidene]cyanamide;[(6E)-6-isocyanoimino-8-(6-methyl-3-pyridinyl)-2-[6-(trifluoromethyl)-3-pyridinyl]indeno[1,2-b]fluoren-12-ylidene]cyanamide has a molecular weight of 6426.17 g/mol, XLogP of 95.46, 26 rotatable bonds, 0 hydrogen bond donors, and 46 hydrogen bond acceptors.
Where does this data come from?
All data for [(6E)-2,8-bis(2,6-difluoro-4-pyridinyl)-6-isocyanoiminoindeno[1,2-b]fluoren-12-ylidene]cyanamide;[(6E)-2,8-bis(6-fluoro-3-pyridinyl)-6-isocyanoiminoindeno[1,2-b]fluoren-12-ylidene]cyanamide;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-2,8-bis(6-fluoro-3-pyridinyl)indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(6Z)-6-[cyano(isocyano)methylidene]-2-(3-methylphenyl)-8-[3-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-12-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-8-(4-methylphenyl)-2-[4-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-8-(2-methyl-4-pyridinyl)-2-[2-(trifluoromethyl)-4-pyridinyl]indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;(2E)-2-[(12Z)-12-[cyano(isocyano)methylidene]-8-(6-methyl-3-pyridinyl)-2-[6-(trifluoromethyl)-3-pyridinyl]indeno[1,2-b]fluoren-6-ylidene]-2-isocyanoacetonitrile;[(6E)-6-isocyanoimino-8-(4-methylphenyl)-2-[4-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-12-ylidene]cyanamide;[(12E)-12-isocyanoimino-2-(3-methylphenyl)-8-[3-(trifluoromethoxy)phenyl]indeno[1,2-b]fluoren-6-ylidene]cyanamide;[(6E)-6-isocyanoimino-8-(2-methyl-4-pyridinyl)-2-[2-(trifluoromethyl)-4-pyridinyl]indeno[1,2-b]fluoren-12-ylidene]cyanamide;[(6E)-6-isocyanoimino-8-(6-methyl-3-pyridinyl)-2-[6-(trifluoromethyl)-3-pyridinyl]indeno[1,2-b]fluoren-12-ylidene]cyanamide is sourced from PubChem (CID 172985383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).