N,N-bis(4-methoxyphenyl)-10-(9-phenylpurin-8-yl)anthracen-9-amine;N-[4-[2-[4-(1-naphthalen-2-ylimidazo[4,5-c]pyridin-2-yl)phenyl]-3a,6a-dihydrothieno[3,2-b]thiophen-5-yl]phenyl]-N-phenylnaphthalen-1-amine;4-(3-naphthalen-2-ylimidazo[4,5-d]pyridazin-2-yl)-N,N-bis[(E)-2-phenylethenyl]aniline;5-(3-phenylimidazo[4,5-b]pyridin-2-yl)-N,N-dithiophen-2-ylthiophen-2-amine;N-[4-(3-phenylimidazo[4,5-b]quinolin-2-yl)phenyl]-N-pyridin-4-ylpyridin-4-amine;N-phenyl-N-[3-(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]naphthalen-2-amine;N-[4-[5-[4-(3-phenylthieno[2,3-d]imidazol-2-yl)phenyl]thiophen-2-yl]phenyl]-N-piperidin-4-ylpiperidin-4-amine;9-[2-(3-quinolin-5-ylimidazo[4,5-b]pyridin-2-yl)thieno[3,2-b]thiophen-5-yl]carbazole

C286H208N38O2S9 — CID 158287313

IUPACN,N-bis(4-methoxyphenyl)-10-(9-phenylpurin-8-yl)anthracen-9-amine;N-[4-[2-[4-(1-naphthalen-2-ylimidazo[4,5-c]pyridin-2-yl)phenyl]-3a,6a-dihydrothieno[3,2-b]thiophen-5-yl]phenyl]-N-phenylnaphthalen-1-amine;4-(3-naphthalen-2-ylimidazo[4,5-d]pyridazin-2-yl)-N,N-bis[(E)-2-phenylethenyl]aniline;5-(3-phenylimidazo[4,5-b]pyridin-2-yl)-N,N-dithiophen-2-ylthiophen-2-amine;N-[4-(3-phenylimidazo[4,5-b]quinolin-2-yl)phenyl]-N-pyridin-4-ylpyridin-4-amine;N-phenyl-N-[3-(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]naphthalen-2-amine;N-[4-[5-[4-(3-phenylthieno[2,3-d]imidazol-2-yl)phenyl]thiophen-2-yl]phenyl]-N-piperidin-4-ylpiperidin-4-amine;9-[2-(3-quinolin-5-ylimidazo[4,5-b]pyridin-2-yl)thieno[3,2-b]thiophen-5-yl]carbazole
SMILESC(=C/N(/C=C/c1ccccc1)c1ccc(-c2nc3cnncc3n2-c2ccc3ccccc3c2)cc1)\c1ccccc1.C1=C(c2ccc(-c3nc4cnccc4n3-c3ccc4ccccc4c3)cc2)SC2C=C(c3ccc(N(c4ccccc4)c4cccc5ccccc45)cc3)SC12.COc1ccc(N(c2ccc(OC)cc2)c2c3ccccc3c(-c3nc4cncnc4n3-c3ccccc3)c3ccccc23)cc1.c1cc(-n2c(-c3cc4sc(-n5c6ccccc6c6ccccc65)cc4s3)nc3cccnc32)c2cccnc2c1.c1ccc(-n2c(-c3ccc(-c4ccc(-c5ccc(N(C6CCNCC6)C6CCNCC6)cc5)s4)cc3)nc3ccsc32)cc1.c1ccc(-n2c(-c3ccc(N(c4cccs4)c4cccs4)s3)nc3cccnc32)cc1.c1ccc(-n2c(-c3ccc(N(c4ccncc4)c4ccncc4)cc3)nc3cc4ccccc4nc32)cc1.c1ccc(N(c2cccc(-c3nc4cccnc4n3-c3ccccc3)c2)c2ccc3ccccc3c2)cc1
InChIInChI=1S/C50H34N4S2.C39H29N5O2.C37H37N5S2.C37H27N5.C34H24N4.C33H19N5S2.C32H22N6.C24H16N4S3/c1-2-13-39(14-3-1)53(44-16-8-12-34-10-6-7-15-42(34)44)40-24-22-36(23-25-40)47-31-49-48(56-47)30-46(55-49)35-17-19-37(20-18-35)50-52-43-32-51-28-27-45(43)54(50)41-26-21-33-9-4-5-11-38(33)29-41;1-45-29-20-16-27(17-21-29)43(28-18-22-30(46-2)23-19-28)37-33-14-8-6-12-31(33)36(32-13-7-9-15-34(32)37)39-42-35-24-40-25-41-38(35)44(39)26-10-4-3-5-11-26;1-2-4-29(5-3-1)42-36(40-33-20-25-43-37(33)42)28-8-6-26(7-9-28)34-14-15-35(44-34)27-10-12-30(13-11-27)41(31-16-21-38-22-17-31)32-18-23-39-24-19-32;1-3-9-28(10-4-1)21-23-41(24-22-29-11-5-2-6-12-29)33-18-16-31(17-19-33)37-40-35-26-38-39-27-36(35)42(37)34-20-15-30-13-7-8-14-32(30)25-34;1-3-14-28(15-4-1)37(31-21-20-25-11-7-8-12-26(25)23-31)30-18-9-13-27(24-30)33-36-32-19-10-22-35-34(32)38(33)29-16-5-2-6-17-29;1-3-13-25-20(8-1)21-9-2-4-14-26(21)37(25)31-19-29-28(40-31)18-30(39-29)33-36-24-12-7-17-35-32(24)38(33)27-15-5-11-23-22(27)10-6-16-34-23;1-2-7-25(8-3-1)38-31(36-30-22-24-6-4-5-9-29(24)35-32(30)38)23-10-12-26(13-11-23)37(27-14-18-33-19-15-27)28-16-20-34-21-17-28;1-2-7-17(8-3-1)27-23-18(9-4-14-25-23)26-24(27)19-12-13-22(31-19)28(20-10-5-15-29-20)21-11-6-16-30-21/h1-32,48-49H;3-25H,1-2H3;1-15,20,25,31-32,38-39H,16-19,21-24H2;1-27H;1-24H;1-19H;1-22H;1-16H/b;;;23-21+,24-22+;;;;
InChIKeyGKXXAYWKOXRFFE-HMTGXNPUSA-N
MW4497.68 g/mol
LogP72.96
Rot. Bonds46

About N,N-bis(4-methoxyphenyl)-10-(9-phenylpurin-8-yl)anthracen-9-amine;N-[4-[2-[4-(1-naphthalen-2-ylimidazo[4,5-c]pyridin-2-yl)phenyl]-3a,6a-dihydrothieno[3,2-b]thiophen-5-yl]phenyl]-N-phenylnaphthalen-1-amine;4-(3-naphthalen-2-ylimidazo[4,5-d]pyridazin-2-yl)-N,N-bis[(E)-2-phenylethenyl]aniline;5-(3-phenylimidazo[4,5-b]pyridin-2-yl)-N,N-dithiophen-2-ylthiophen-2-amine;N-[4-(3-phenylimidazo[4,5-b]quinolin-2-yl)phenyl]-N-pyridin-4-ylpyridin-4-amine;N-phenyl-N-[3-(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]naphthalen-2-amine;N-[4-[5-[4-(3-phenylthieno[2,3-d]imidazol-2-yl)phenyl]thiophen-2-yl]phenyl]-N-piperidin-4-ylpiperidin-4-amine;9-[2-(3-quinolin-5-ylimidazo[4,5-b]pyridin-2-yl)thieno[3,2-b]thiophen-5-yl]carbazole

N,N-bis(4-methoxyphenyl)-10-(9-phenylpurin-8-yl)anthracen-9-amine;N-[4-[2-[4-(1-naphthalen-2-ylimidazo[4,5-c]pyridin-2-yl)phenyl]-3a,6a-dihydrothieno[3,2-b]thiophen-5-yl]phenyl]-N-phenylnaphthalen-1-amine;4-(3-naphthalen-2-ylimidazo[4,5-d]pyridazin-2-yl)-N,N-bis[(E)-2-phenylethenyl]aniline;5-(3-phenylimidazo[4,5-b]pyridin-2-yl)-N,N-dithiophen-2-ylthiophen-2-amine;N-[4-(3-phenylimidazo[4,5-b]quinolin-2-yl)phenyl]-N-pyridin-4-ylpyridin-4-amine;N-phenyl-N-[3-(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]naphthalen-2-amine;N-[4-[5-[4-(3-phenylthieno[2,3-d]imidazol-2-yl)phenyl]thiophen-2-yl]phenyl]-N-piperidin-4-ylpiperidin-4-amine;9-[2-(3-quinolin-5-ylimidazo[4,5-b]pyridin-2-yl)thieno[3,2-b]thiophen-5-yl]carbazole (PubChem CID 158287313) has the molecular formula C286H208N38O2S9 and a molecular weight of 4497.68 g/mol. Its IUPAC name is N,N-bis(4-methoxyphenyl)-10-(9-phenylpurin-8-yl)anthracen-9-amine;N-[4-[2-[4-(1-naphthalen-2-ylimidazo[4,5-c]pyridin-2-yl)phenyl]-3a,6a-dihydrothieno[3,2-b]thiophen-5-yl]phenyl]-N-phenylnaphthalen-1-amine;4-(3-naphthalen-2-ylimidazo[4,5-d]pyridazin-2-yl)-N,N-bis[(E)-2-phenylethenyl]aniline;5-(3-phenylimidazo[4,5-b]pyridin-2-yl)-N,N-dithiophen-2-ylthiophen-2-amine;N-[4-(3-phenylimidazo[4,5-b]quinolin-2-yl)phenyl]-N-pyridin-4-ylpyridin-4-amine;N-phenyl-N-[3-(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]naphthalen-2-amine;N-[4-[5-[4-(3-phenylthieno[2,3-d]imidazol-2-yl)phenyl]thiophen-2-yl]phenyl]-N-piperidin-4-ylpiperidin-4-amine;9-[2-(3-quinolin-5-ylimidazo[4,5-b]pyridin-2-yl)thieno[3,2-b]thiophen-5-yl]carbazole.

Molecular Properties

Compound NameN,N-bis(4-methoxyphenyl)-10-(9-phenylpurin-8-yl)anthracen-9-amine;N-[4-[2-[4-(1-naphthalen-2-ylimidazo[4,5-c]pyridin-2-yl)phenyl]-3a,6a-dihydrothieno[3,2-b]thiophen-5-yl]phenyl]-N-phenylnaphthalen-1-amine;4-(3-naphthalen-2-ylimidazo[4,5-d]pyridazin-2-yl)-N,N-bis[(E)-2-phenylethenyl]aniline;5-(3-phenylimidazo[4,5-b]pyridin-2-yl)-N,N-dithiophen-2-ylthiophen-2-amine;N-[4-(3-phenylimidazo[4,5-b]quinolin-2-yl)phenyl]-N-pyridin-4-ylpyridin-4-amine;N-phenyl-N-[3-(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]naphthalen-2-amine;N-[4-[5-[4-(3-phenylthieno[2,3-d]imidazol-2-yl)phenyl]thiophen-2-yl]phenyl]-N-piperidin-4-ylpiperidin-4-amine;9-[2-(3-quinolin-5-ylimidazo[4,5-b]pyridin-2-yl)thieno[3,2-b]thiophen-5-yl]carbazole
PubChem CID158287313
Molecular FormulaC286H208N38O2S9
Molecular Weight4497.68 g/mol
Exact Mass4493.48
IUPAC NameN,N-bis(4-methoxyphenyl)-10-(9-phenylpurin-8-yl)anthracen-9-amine;N-[4-[2-[4-(1-naphthalen-2-ylimidazo[4,5-c]pyridin-2-yl)phenyl]-3a,6a-dihydrothieno[3,2-b]thiophen-5-yl]phenyl]-N-phenylnaphthalen-1-amine;4-(3-naphthalen-2-ylimidazo[4,5-d]pyridazin-2-yl)-N,N-bis[(E)-2-phenylethenyl]aniline;5-(3-phenylimidazo[4,5-b]pyridin-2-yl)-N,N-dithiophen-2-ylthiophen-2-amine;N-[4-(3-phenylimidazo[4,5-b]quinolin-2-yl)phenyl]-N-pyridin-4-ylpyridin-4-amine;N-phenyl-N-[3-(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]naphthalen-2-amine;N-[4-[5-[4-(3-phenylthieno[2,3-d]imidazol-2-yl)phenyl]thiophen-2-yl]phenyl]-N-piperidin-4-ylpiperidin-4-amine;9-[2-(3-quinolin-5-ylimidazo[4,5-b]pyridin-2-yl)thieno[3,2-b]thiophen-5-yl]carbazole
SMILESC(=C/N(/C=C/c1ccccc1)c1ccc(-c2nc3cnncc3n2-c2ccc3ccccc3c2)cc1)\c1ccccc1.C1=C(c2ccc(-c3nc4cnccc4n3-c3ccc4ccccc4c3)cc2)SC2C=C(c3ccc(N(c4ccccc4)c4cccc5ccccc45)cc3)SC12.COc1ccc(N(c2ccc(OC)cc2)c2c3ccccc3c(-c3nc4cncnc4n3-c3ccccc3)c3ccccc23)cc1.c1cc(-n2c(-c3cc4sc(-n5c6ccccc6c6ccccc65)cc4s3)nc3cccnc32)c2cccnc2c1.c1ccc(-n2c(-c3ccc(-c4ccc(-c5ccc(N(C6CCNCC6)C6CCNCC6)cc5)s4)cc3)nc3ccsc32)cc1.c1ccc(-n2c(-c3ccc(N(c4cccs4)c4cccs4)s3)nc3cccnc32)cc1.c1ccc(-n2c(-c3ccc(N(c4ccncc4)c4ccncc4)cc3)nc3cc4ccccc4nc32)cc1.c1ccc(N(c2cccc(-c3nc4cccnc4n3-c3ccccc3)c2)c2ccc3ccccc3c2)cc1
InChIInChI=1S/C50H34N4S2.C39H29N5O2.C37H37N5S2.C37H27N5.C34H24N4.C33H19N5S2.C32H22N6.C24H16N4S3/c1-2-13-39(14-3-1)53(44-16-8-12-34-10-6-7-15-42(34)44)40-24-22-36(23-25-40)47-31-49-48(56-47)30-46(55-49)35-17-19-37(20-18-35)50-52-43-32-51-28-27-45(43)54(50)41-26-21-33-9-4-5-11-38(33)29-41;1-45-29-20-16-27(17-21-29)43(28-18-22-30(46-2)23-19-28)37-33-14-8-6-12-31(33)36(32-13-7-9-15-34(32)37)39-42-35-24-40-25-41-38(35)44(39)26-10-4-3-5-11-26;1-2-4-29(5-3-1)42-36(40-33-20-25-43-37(33)42)28-8-6-26(7-9-28)34-14-15-35(44-34)27-10-12-30(13-11-27)41(31-16-21-38-22-17-31)32-18-23-39-24-19-32;1-3-9-28(10-4-1)21-23-41(24-22-29-11-5-2-6-12-29)33-18-16-31(17-19-33)37-40-35-26-38-39-27-36(35)42(37)34-20-15-30-13-7-8-14-32(30)25-34;1-3-14-28(15-4-1)37(31-21-20-25-11-7-8-12-26(25)23-31)30-18-9-13-27(24-30)33-36-32-19-10-22-35-34(32)38(33)29-16-5-2-6-17-29;1-3-13-25-20(8-1)21-9-2-4-14-26(21)37(25)31-19-29-28(40-31)18-30(39-29)33-36-24-12-7-17-35-32(24)38(33)27-15-5-11-23-22(27)10-6-16-34-23;1-2-7-25(8-3-1)38-31(36-30-22-24-6-4-5-9-29(24)35-32(30)38)23-10-12-26(13-11-23)37(27-14-18-33-19-15-27)28-16-20-34-21-17-28;1-2-7-17(8-3-1)27-23-18(9-4-14-25-23)26-24(27)19-12-13-22(31-19)28(20-10-5-15-29-20)21-11-6-16-30-21/h1-32,48-49H;3-25H,1-2H3;1-15,20,25,31-32,38-39H,16-19,21-24H2;1-27H;1-24H;1-19H;1-22H;1-16H/b;;;23-21+,24-22+;;;;
InChIKeyGKXXAYWKOXRFFE-HMTGXNPUSA-N
XLogP72.96
TPSA367.37 Ų
H-Bond Donors2
H-Bond Acceptors49
Rotatable Bonds46
Heavy Atoms335
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004497.68
LogP ≤ 572.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1049

Analyze N,N-bis(4-methoxyphenyl)-10-(9-phenylpurin-8-yl)anthracen-9-amine;N-[4-[2-[4-(1-naphthalen-2-ylimidazo[4,5-c]pyridin-2-yl)phenyl]-3a,6a-dihydrothieno[3,2-b]thiophen-5-yl]phenyl]-N-phenylnaphthalen-1-amine;4-(3-naphthalen-2-ylimidazo[4,5-d]pyridazin-2-yl)-N,N-bis[(E)-2-phenylethenyl]aniline;5-(3-phenylimidazo[4,5-b]pyridin-2-yl)-N,N-dithiophen-2-ylthiophen-2-amine;N-[4-(3-phenylimidazo[4,5-b]quinolin-2-yl)phenyl]-N-pyridin-4-ylpyridin-4-amine;N-phenyl-N-[3-(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]naphthalen-2-amine;N-[4-[5-[4-(3-phenylthieno[2,3-d]imidazol-2-yl)phenyl]thiophen-2-yl]phenyl]-N-piperidin-4-ylpiperidin-4-amine;9-[2-(3-quinolin-5-ylimidazo[4,5-b]pyridin-2-yl)thieno[3,2-b]thiophen-5-yl]carbazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of N,N-bis(4-methoxyphenyl)-10-(9-phenylpurin-8-yl)anthracen-9-amine;N-[4-[2-[4-(1-naphthalen-2-ylimidazo[4,5-c]pyridin-2-yl)phenyl]-3a,6a-dihydrothieno[3,2-b]thiophen-5-yl]phenyl]-N-phenylnaphthalen-1-amine;4-(3-naphthalen-2-ylimidazo[4,5-d]pyridazin-2-yl)-N,N-bis[(E)-2-phenylethenyl]aniline;5-(3-phenylimidazo[4,5-b]pyridin-2-yl)-N,N-dithiophen-2-ylthiophen-2-amine;N-[4-(3-phenylimidazo[4,5-b]quinolin-2-yl)phenyl]-N-pyridin-4-ylpyridin-4-amine;N-phenyl-N-[3-(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]naphthalen-2-amine;N-[4-[5-[4-(3-phenylthieno[2,3-d]imidazol-2-yl)phenyl]thiophen-2-yl]phenyl]-N-piperidin-4-ylpiperidin-4-amine;9-[2-(3-quinolin-5-ylimidazo[4,5-b]pyridin-2-yl)thieno[3,2-b]thiophen-5-yl]carbazole?
The IUPAC name of N,N-bis(4-methoxyphenyl)-10-(9-phenylpurin-8-yl)anthracen-9-amine;N-[4-[2-[4-(1-naphthalen-2-ylimidazo[4,5-c]pyridin-2-yl)phenyl]-3a,6a-dihydrothieno[3,2-b]thiophen-5-yl]phenyl]-N-phenylnaphthalen-1-amine;4-(3-naphthalen-2-ylimidazo[4,5-d]pyridazin-2-yl)-N,N-bis[(E)-2-phenylethenyl]aniline;5-(3-phenylimidazo[4,5-b]pyridin-2-yl)-N,N-dithiophen-2-ylthiophen-2-amine;N-[4-(3-phenylimidazo[4,5-b]quinolin-2-yl)phenyl]-N-pyridin-4-ylpyridin-4-amine;N-phenyl-N-[3-(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]naphthalen-2-amine;N-[4-[5-[4-(3-phenylthieno[2,3-d]imidazol-2-yl)phenyl]thiophen-2-yl]phenyl]-N-piperidin-4-ylpiperidin-4-amine;9-[2-(3-quinolin-5-ylimidazo[4,5-b]pyridin-2-yl)thieno[3,2-b]thiophen-5-yl]carbazole (CID 158287313) is N,N-bis(4-methoxyphenyl)-10-(9-phenylpurin-8-yl)anthracen-9-amine;N-[4-[2-[4-(1-naphthalen-2-ylimidazo[4,5-c]pyridin-2-yl)phenyl]-3a,6a-dihydrothieno[3,2-b]thiophen-5-yl]phenyl]-N-phenylnaphthalen-1-amine;4-(3-naphthalen-2-ylimidazo[4,5-d]pyridazin-2-yl)-N,N-bis[(E)-2-phenylethenyl]aniline;5-(3-phenylimidazo[4,5-b]pyridin-2-yl)-N,N-dithiophen-2-ylthiophen-2-amine;N-[4-(3-phenylimidazo[4,5-b]quinolin-2-yl)phenyl]-N-pyridin-4-ylpyridin-4-amine;N-phenyl-N-[3-(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]naphthalen-2-amine;N-[4-[5-[4-(3-phenylthieno[2,3-d]imidazol-2-yl)phenyl]thiophen-2-yl]phenyl]-N-piperidin-4-ylpiperidin-4-amine;9-[2-(3-quinolin-5-ylimidazo[4,5-b]pyridin-2-yl)thieno[3,2-b]thiophen-5-yl]carbazole.
What is the SMILES notation for N,N-bis(4-methoxyphenyl)-10-(9-phenylpurin-8-yl)anthracen-9-amine;N-[4-[2-[4-(1-naphthalen-2-ylimidazo[4,5-c]pyridin-2-yl)phenyl]-3a,6a-dihydrothieno[3,2-b]thiophen-5-yl]phenyl]-N-phenylnaphthalen-1-amine;4-(3-naphthalen-2-ylimidazo[4,5-d]pyridazin-2-yl)-N,N-bis[(E)-2-phenylethenyl]aniline;5-(3-phenylimidazo[4,5-b]pyridin-2-yl)-N,N-dithiophen-2-ylthiophen-2-amine;N-[4-(3-phenylimidazo[4,5-b]quinolin-2-yl)phenyl]-N-pyridin-4-ylpyridin-4-amine;N-phenyl-N-[3-(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]naphthalen-2-amine;N-[4-[5-[4-(3-phenylthieno[2,3-d]imidazol-2-yl)phenyl]thiophen-2-yl]phenyl]-N-piperidin-4-ylpiperidin-4-amine;9-[2-(3-quinolin-5-ylimidazo[4,5-b]pyridin-2-yl)thieno[3,2-b]thiophen-5-yl]carbazole?
The canonical SMILES for N,N-bis(4-methoxyphenyl)-10-(9-phenylpurin-8-yl)anthracen-9-amine;N-[4-[2-[4-(1-naphthalen-2-ylimidazo[4,5-c]pyridin-2-yl)phenyl]-3a,6a-dihydrothieno[3,2-b]thiophen-5-yl]phenyl]-N-phenylnaphthalen-1-amine;4-(3-naphthalen-2-ylimidazo[4,5-d]pyridazin-2-yl)-N,N-bis[(E)-2-phenylethenyl]aniline;5-(3-phenylimidazo[4,5-b]pyridin-2-yl)-N,N-dithiophen-2-ylthiophen-2-amine;N-[4-(3-phenylimidazo[4,5-b]quinolin-2-yl)phenyl]-N-pyridin-4-ylpyridin-4-amine;N-phenyl-N-[3-(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]naphthalen-2-amine;N-[4-[5-[4-(3-phenylthieno[2,3-d]imidazol-2-yl)phenyl]thiophen-2-yl]phenyl]-N-piperidin-4-ylpiperidin-4-amine;9-[2-(3-quinolin-5-ylimidazo[4,5-b]pyridin-2-yl)thieno[3,2-b]thiophen-5-yl]carbazole is C(=C/N(/C=C/c1ccccc1)c1ccc(-c2nc3cnncc3n2-c2ccc3ccccc3c2)cc1)\c1ccccc1.C1=C(c2ccc(-c3nc4cnccc4n3-c3ccc4ccccc4c3)cc2)SC2C=C(c3ccc(N(c4ccccc4)c4cccc5ccccc45)cc3)SC12.COc1ccc(N(c2ccc(OC)cc2)c2c3ccccc3c(-c3nc4cncnc4n3-c3ccccc3)c3ccccc23)cc1.c1cc(-n2c(-c3cc4sc(-n5c6ccccc6c6ccccc65)cc4s3)nc3cccnc32)c2cccnc2c1.c1ccc(-n2c(-c3ccc(-c4ccc(-c5ccc(N(C6CCNCC6)C6CCNCC6)cc5)s4)cc3)nc3ccsc32)cc1.c1ccc(-n2c(-c3ccc(N(c4cccs4)c4cccs4)s3)nc3cccnc32)cc1.c1ccc(-n2c(-c3ccc(N(c4ccncc4)c4ccncc4)cc3)nc3cc4ccccc4nc32)cc1.c1ccc(N(c2cccc(-c3nc4cccnc4n3-c3ccccc3)c2)c2ccc3ccccc3c2)cc1.
What is the InChIKey of N,N-bis(4-methoxyphenyl)-10-(9-phenylpurin-8-yl)anthracen-9-amine;N-[4-[2-[4-(1-naphthalen-2-ylimidazo[4,5-c]pyridin-2-yl)phenyl]-3a,6a-dihydrothieno[3,2-b]thiophen-5-yl]phenyl]-N-phenylnaphthalen-1-amine;4-(3-naphthalen-2-ylimidazo[4,5-d]pyridazin-2-yl)-N,N-bis[(E)-2-phenylethenyl]aniline;5-(3-phenylimidazo[4,5-b]pyridin-2-yl)-N,N-dithiophen-2-ylthiophen-2-amine;N-[4-(3-phenylimidazo[4,5-b]quinolin-2-yl)phenyl]-N-pyridin-4-ylpyridin-4-amine;N-phenyl-N-[3-(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]naphthalen-2-amine;N-[4-[5-[4-(3-phenylthieno[2,3-d]imidazol-2-yl)phenyl]thiophen-2-yl]phenyl]-N-piperidin-4-ylpiperidin-4-amine;9-[2-(3-quinolin-5-ylimidazo[4,5-b]pyridin-2-yl)thieno[3,2-b]thiophen-5-yl]carbazole?
The InChIKey is GKXXAYWKOXRFFE-HMTGXNPUSA-N. The full InChI is InChI=1S/C50H34N4S2.C39H29N5O2.C37H37N5S2.C37H27N5.C34H24N4.C33H19N5S2.C32H22N6.C24H16N4S3/c1-2-13-39(14-3-1)53(44-16-8-12-34-10-6-7-15-42(34)44)40-24-22-36(23-25-40)47-31-49-48(56-47)30-46(55-49)35-17-19-37(20-18-35)50-52-43-32-51-28-27-45(43)54(50)41-26-21-33-9-4-5-11-38(33)29-41;1-45-29-20-16-27(17-21-29)43(28-18-22-30(46-2)23-19-28)37-33-14-8-6-12-31(33)36(32-13-7-9-15-34(32)37)39-42-35-24-40-25-41-38(35)44(39)26-10-4-3-5-11-26;1-2-4-29(5-3-1)42-36(40-33-20-25-43-37(33)42)28-8-6-26(7-9-28)34-14-15-35(44-34)27-10-12-30(13-11-27)41(31-16-21-38-22-17-31)32-18-23-39-24-19-32;1-3-9-28(10-4-1)21-23-41(24-22-29-11-5-2-6-12-29)33-18-16-31(17-19-33)37-40-35-26-38-39-27-36(35)42(37)34-20-15-30-13-7-8-14-32(30)25-34;1-3-14-28(15-4-1)37(31-21-20-25-11-7-8-12-26(25)23-31)30-18-9-13-27(24-30)33-36-32-19-10-22-35-34(32)38(33)29-16-5-2-6-17-29;1-3-13-25-20(8-1)21-9-2-4-14-26(21)37(25)31-19-29-28(40-31)18-30(39-29)33-36-24-12-7-17-35-32(24)38(33)27-15-5-11-23-22(27)10-6-16-34-23;1-2-7-25(8-3-1)38-31(36-30-22-24-6-4-5-9-29(24)35-32(30)38)23-10-12-26(13-11-23)37(27-14-18-33-19-15-27)28-16-20-34-21-17-28;1-2-7-17(8-3-1)27-23-18(9-4-14-25-23)26-24(27)19-12-13-22(31-19)28(20-10-5-15-29-20)21-11-6-16-30-21/h1-32,48-49H;3-25H,1-2H3;1-15,20,25,31-32,38-39H,16-19,21-24H2;1-27H;1-24H;1-19H;1-22H;1-16H/b;;;23-21+,24-22+;;;;.
What are the key properties of N,N-bis(4-methoxyphenyl)-10-(9-phenylpurin-8-yl)anthracen-9-amine;N-[4-[2-[4-(1-naphthalen-2-ylimidazo[4,5-c]pyridin-2-yl)phenyl]-3a,6a-dihydrothieno[3,2-b]thiophen-5-yl]phenyl]-N-phenylnaphthalen-1-amine;4-(3-naphthalen-2-ylimidazo[4,5-d]pyridazin-2-yl)-N,N-bis[(E)-2-phenylethenyl]aniline;5-(3-phenylimidazo[4,5-b]pyridin-2-yl)-N,N-dithiophen-2-ylthiophen-2-amine;N-[4-(3-phenylimidazo[4,5-b]quinolin-2-yl)phenyl]-N-pyridin-4-ylpyridin-4-amine;N-phenyl-N-[3-(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]naphthalen-2-amine;N-[4-[5-[4-(3-phenylthieno[2,3-d]imidazol-2-yl)phenyl]thiophen-2-yl]phenyl]-N-piperidin-4-ylpiperidin-4-amine;9-[2-(3-quinolin-5-ylimidazo[4,5-b]pyridin-2-yl)thieno[3,2-b]thiophen-5-yl]carbazole?
N,N-bis(4-methoxyphenyl)-10-(9-phenylpurin-8-yl)anthracen-9-amine;N-[4-[2-[4-(1-naphthalen-2-ylimidazo[4,5-c]pyridin-2-yl)phenyl]-3a,6a-dihydrothieno[3,2-b]thiophen-5-yl]phenyl]-N-phenylnaphthalen-1-amine;4-(3-naphthalen-2-ylimidazo[4,5-d]pyridazin-2-yl)-N,N-bis[(E)-2-phenylethenyl]aniline;5-(3-phenylimidazo[4,5-b]pyridin-2-yl)-N,N-dithiophen-2-ylthiophen-2-amine;N-[4-(3-phenylimidazo[4,5-b]quinolin-2-yl)phenyl]-N-pyridin-4-ylpyridin-4-amine;N-phenyl-N-[3-(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]naphthalen-2-amine;N-[4-[5-[4-(3-phenylthieno[2,3-d]imidazol-2-yl)phenyl]thiophen-2-yl]phenyl]-N-piperidin-4-ylpiperidin-4-amine;9-[2-(3-quinolin-5-ylimidazo[4,5-b]pyridin-2-yl)thieno[3,2-b]thiophen-5-yl]carbazole has a molecular weight of 4497.68 g/mol, XLogP of 72.96, 46 rotatable bonds, 2 hydrogen bond donors, and 49 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(4-methoxyphenyl)-10-(9-phenylpurin-8-yl)anthracen-9-amine;N-[4-[2-[4-(1-naphthalen-2-ylimidazo[4,5-c]pyridin-2-yl)phenyl]-3a,6a-dihydrothieno[3,2-b]thiophen-5-yl]phenyl]-N-phenylnaphthalen-1-amine;4-(3-naphthalen-2-ylimidazo[4,5-d]pyridazin-2-yl)-N,N-bis[(E)-2-phenylethenyl]aniline;5-(3-phenylimidazo[4,5-b]pyridin-2-yl)-N,N-dithiophen-2-ylthiophen-2-amine;N-[4-(3-phenylimidazo[4,5-b]quinolin-2-yl)phenyl]-N-pyridin-4-ylpyridin-4-amine;N-phenyl-N-[3-(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]naphthalen-2-amine;N-[4-[5-[4-(3-phenylthieno[2,3-d]imidazol-2-yl)phenyl]thiophen-2-yl]phenyl]-N-piperidin-4-ylpiperidin-4-amine;9-[2-(3-quinolin-5-ylimidazo[4,5-b]pyridin-2-yl)thieno[3,2-b]thiophen-5-yl]carbazole is sourced from PubChem (CID 158287313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).