4-[9-[3-(9,9-dimethylfluoren-2-yl)phenyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-[3-(9,9-dimethylfluoren-3-yl)phenyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-[6-(9,9-dimethylfluoren-2-yl)-2-pyridinyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-[6-(9,9-dimethylfluoren-3-yl)-2-pyridinyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-(3-triphenylen-2-ylphenyl)carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-(6-triphenylen-2-yl-2-pyridinyl)carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene

C309H197N15 — CID 159986291

IUPAC4-[9-[3-(9,9-dimethylfluoren-2-yl)phenyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-[3-(9,9-dimethylfluoren-3-yl)phenyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-[6-(9,9-dimethylfluoren-2-yl)-2-pyridinyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-[6-(9,9-dimethylfluoren-3-yl)-2-pyridinyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-(3-triphenylen-2-ylphenyl)carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-(6-triphenylen-2-yl-2-pyridinyl)carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene
SMILESCC1(C)c2ccccc2-c2cc(-c3cccc(-n4c5ccccc5c5cc(-c6ccc7c8cccc9c%10ccccc%10n(c7c6)c98)ccc54)c3)ccc21.CC1(C)c2ccccc2-c2cc(-c3cccc(-n4c5ccccc5c5cc(-c6ccc7c8cccc9c%10ccccc%10n(c7c6)c98)ccc54)n3)ccc21.CC1(C)c2ccccc2-c2ccc(-c3cccc(-n4c5ccccc5c5cc(-c6ccc7c8cccc9c%10ccccc%10n(c7c6)c98)ccc54)c3)cc21.CC1(C)c2ccccc2-c2ccc(-c3cccc(-n4c5ccccc5c5cc(-c6ccc7c8cccc9c%10ccccc%10n(c7c6)c98)ccc54)n3)cc21.c1cc(-c2ccc3c4ccccc4c4ccccc4c3c2)cc(-n2c3ccccc3c3cc(-c4ccc5c6cccc7c8ccccc8n(c5c4)c76)ccc32)c1.c1cc(-c2ccc3c4ccccc4c4ccccc4c3c2)nc(-n2c3ccccc3c3cc(-c4ccc5c6cccc7c8ccccc8n(c5c4)c76)ccc32)c1
InChIInChI=1S/C54H32N2.C53H31N3.2C51H34N2.2C50H33N3/c1-2-15-40-38(13-1)39-14-3-4-16-41(39)48-30-34(23-26-42(40)48)33-11-9-12-37(29-33)55-50-21-7-6-18-44(50)49-31-35(25-28-52(49)55)36-24-27-45-47-20-10-19-46-43-17-5-8-22-51(43)56(54(46)47)53(45)32-36;1-2-13-37-35(11-1)36-12-3-4-14-38(36)45-30-34(24-26-39(37)45)47-19-10-22-52(54-47)55-48-20-7-6-16-41(48)46-29-32(25-28-50(46)55)33-23-27-42-44-18-9-17-43-40-15-5-8-21-49(40)56(53(43)44)51(42)31-33;1-51(2)44-18-6-3-13-36(44)37-24-21-33(29-45(37)51)31-11-9-12-35(27-31)52-46-19-7-5-15-39(46)43-28-32(23-26-48(43)52)34-22-25-40-42-17-10-16-41-38-14-4-8-20-47(38)53(50(41)42)49(40)30-34;1-51(2)44-18-6-3-13-36(44)42-28-32(22-25-45(42)51)31-11-9-12-35(27-31)52-46-19-7-5-15-38(46)43-29-33(23-26-48(43)52)34-21-24-39-41-17-10-16-40-37-14-4-8-20-47(37)53(50(40)41)49(39)30-34;1-50(2)41-16-6-3-11-33(41)34-24-22-32(28-42(34)50)43-17-10-20-48(51-43)52-44-18-7-5-13-36(44)40-27-30(23-26-46(40)52)31-21-25-37-39-15-9-14-38-35-12-4-8-19-45(35)53(49(38)39)47(37)29-31;1-50(2)41-16-6-3-11-33(41)39-28-32(22-25-42(39)50)43-17-10-20-48(51-43)52-44-18-7-5-13-35(44)40-27-30(23-26-46(40)52)31-21-24-36-38-15-9-14-37-34-12-4-8-19-45(34)53(49(37)38)47(36)29-31/h1-32H;1-31H;2*3-30H,1-2H3;2*3-29H,1-2H3
InChIKeyOGJLNEIGXFKOGB-UHFFFAOYSA-N
MW4120.08 g/mol
LogP81.94
Rot. Bonds18

About 4-[9-[3-(9,9-dimethylfluoren-2-yl)phenyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-[3-(9,9-dimethylfluoren-3-yl)phenyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-[6-(9,9-dimethylfluoren-2-yl)-2-pyridinyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-[6-(9,9-dimethylfluoren-3-yl)-2-pyridinyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-(3-triphenylen-2-ylphenyl)carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-(6-triphenylen-2-yl-2-pyridinyl)carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene

4-[9-[3-(9,9-dimethylfluoren-2-yl)phenyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-[3-(9,9-dimethylfluoren-3-yl)phenyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-[6-(9,9-dimethylfluoren-2-yl)-2-pyridinyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-[6-(9,9-dimethylfluoren-3-yl)-2-pyridinyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-(3-triphenylen-2-ylphenyl)carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-(6-triphenylen-2-yl-2-pyridinyl)carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene (PubChem CID 159986291) has the molecular formula C309H197N15 and a molecular weight of 4120.08 g/mol. Its IUPAC name is 4-[9-[3-(9,9-dimethylfluoren-2-yl)phenyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-[3-(9,9-dimethylfluoren-3-yl)phenyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-[6-(9,9-dimethylfluoren-2-yl)-2-pyridinyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-[6-(9,9-dimethylfluoren-3-yl)-2-pyridinyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-(3-triphenylen-2-ylphenyl)carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-(6-triphenylen-2-yl-2-pyridinyl)carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene.

Molecular Properties

Compound Name4-[9-[3-(9,9-dimethylfluoren-2-yl)phenyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-[3-(9,9-dimethylfluoren-3-yl)phenyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-[6-(9,9-dimethylfluoren-2-yl)-2-pyridinyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-[6-(9,9-dimethylfluoren-3-yl)-2-pyridinyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-(3-triphenylen-2-ylphenyl)carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-(6-triphenylen-2-yl-2-pyridinyl)carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene
PubChem CID159986291
Molecular FormulaC309H197N15
Molecular Weight4120.08 g/mol
Exact Mass4116.59
IUPAC Name4-[9-[3-(9,9-dimethylfluoren-2-yl)phenyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-[3-(9,9-dimethylfluoren-3-yl)phenyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-[6-(9,9-dimethylfluoren-2-yl)-2-pyridinyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-[6-(9,9-dimethylfluoren-3-yl)-2-pyridinyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-(3-triphenylen-2-ylphenyl)carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-(6-triphenylen-2-yl-2-pyridinyl)carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene
SMILESCC1(C)c2ccccc2-c2cc(-c3cccc(-n4c5ccccc5c5cc(-c6ccc7c8cccc9c%10ccccc%10n(c7c6)c98)ccc54)c3)ccc21.CC1(C)c2ccccc2-c2cc(-c3cccc(-n4c5ccccc5c5cc(-c6ccc7c8cccc9c%10ccccc%10n(c7c6)c98)ccc54)n3)ccc21.CC1(C)c2ccccc2-c2ccc(-c3cccc(-n4c5ccccc5c5cc(-c6ccc7c8cccc9c%10ccccc%10n(c7c6)c98)ccc54)c3)cc21.CC1(C)c2ccccc2-c2ccc(-c3cccc(-n4c5ccccc5c5cc(-c6ccc7c8cccc9c%10ccccc%10n(c7c6)c98)ccc54)n3)cc21.c1cc(-c2ccc3c4ccccc4c4ccccc4c3c2)cc(-n2c3ccccc3c3cc(-c4ccc5c6cccc7c8ccccc8n(c5c4)c76)ccc32)c1.c1cc(-c2ccc3c4ccccc4c4ccccc4c3c2)nc(-n2c3ccccc3c3cc(-c4ccc5c6cccc7c8ccccc8n(c5c4)c76)ccc32)c1
InChIInChI=1S/C54H32N2.C53H31N3.2C51H34N2.2C50H33N3/c1-2-15-40-38(13-1)39-14-3-4-16-41(39)48-30-34(23-26-42(40)48)33-11-9-12-37(29-33)55-50-21-7-6-18-44(50)49-31-35(25-28-52(49)55)36-24-27-45-47-20-10-19-46-43-17-5-8-22-51(43)56(54(46)47)53(45)32-36;1-2-13-37-35(11-1)36-12-3-4-14-38(36)45-30-34(24-26-39(37)45)47-19-10-22-52(54-47)55-48-20-7-6-16-41(48)46-29-32(25-28-50(46)55)33-23-27-42-44-18-9-17-43-40-15-5-8-21-49(40)56(53(43)44)51(42)31-33;1-51(2)44-18-6-3-13-36(44)37-24-21-33(29-45(37)51)31-11-9-12-35(27-31)52-46-19-7-5-15-39(46)43-28-32(23-26-48(43)52)34-22-25-40-42-17-10-16-41-38-14-4-8-20-47(38)53(50(41)42)49(40)30-34;1-51(2)44-18-6-3-13-36(44)42-28-32(22-25-45(42)51)31-11-9-12-35(27-31)52-46-19-7-5-15-38(46)43-29-33(23-26-48(43)52)34-21-24-39-41-17-10-16-40-37-14-4-8-20-47(37)53(50(40)41)49(39)30-34;1-50(2)41-16-6-3-11-33(41)34-24-22-32(28-42(34)50)43-17-10-20-48(51-43)52-44-18-7-5-13-36(44)40-27-30(23-26-46(40)52)31-21-25-37-39-15-9-14-38-35-12-4-8-19-45(35)53(49(38)39)47(37)29-31;1-50(2)41-16-6-3-11-33(41)39-28-32(22-25-42(39)50)43-17-10-20-48(51-43)52-44-18-7-5-13-35(44)40-27-30(23-26-46(40)52)31-21-24-36-38-15-9-14-37-34-12-4-8-19-45(34)53(49(37)38)47(36)29-31/h1-32H;1-31H;2*3-30H,1-2H3;2*3-29H,1-2H3
InChIKeyOGJLNEIGXFKOGB-UHFFFAOYSA-N
XLogP81.94
TPSA94.71 Ų
H-Bond Donors
H-Bond Acceptors15
Rotatable Bonds18
Heavy Atoms324
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004120.08
LogP ≤ 581.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1015

Analyze 4-[9-[3-(9,9-dimethylfluoren-2-yl)phenyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-[3-(9,9-dimethylfluoren-3-yl)phenyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-[6-(9,9-dimethylfluoren-2-yl)-2-pyridinyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-[6-(9,9-dimethylfluoren-3-yl)-2-pyridinyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-(3-triphenylen-2-ylphenyl)carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-(6-triphenylen-2-yl-2-pyridinyl)carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene with MolForge

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Related Compounds

4-[6-[9-(9,9-dimethylfluoren-2-yl)carbazol-3-yl]-2-pyridinyl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene
CID 122537534
4-[9-(9,9-dimethylfluoren-2-yl)carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene
CID 122537506
9-[3-(9,9-dimethylfluoren-2-yl)phenyl]-2-(3-triphenylen-2-ylphenyl)carbazole
CID 118919744
4-[3-[9-(9,9-dimethylfluoren-2-yl)carbazol-3-yl]-5-phenylphenyl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene
CID 122537531
12-[3-(9,9-dimethylfluoren-3-yl)phenyl]-1,12-diazaheptacyclo[14.12.0.02,14.05,13.06,11.017,22.023,28]octacosa-2(14),3,5(13),6,8,10,15,17,19,21,23,25,27-tridecaene
CID 118331088
4-[9-(9,9-dimethylfluoren-2-yl)carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-[9-methyl-9-(trideuteriomethyl)fluoren-2-yl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-(3-phenylphenyl)carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-(4-phenylphenyl)carbazol-2-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-[3-(4-phenylphenyl)phenyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-[4-(4-phenylphenyl)phenyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene
CID 159219083
9-[3-[11-[3-(3-carbazol-9-ylphenyl)phenyl]triphenylen-2-yl]phenyl]carbazole;9-[3-[3-[11-[3-(3-carbazol-9-ylphenyl)phenyl]triphenylen-2-yl]phenyl]phenyl]carbazole;9-[6-(3-triphenylen-2-ylphenyl)-2-pyridinyl]carbazole
CID 158139061
2-[4-(9,9-dimethylfluoren-2-yl)-6-[3-(3-phenylcarbazol-9-yl)phenyl]-1,3,5-triazin-2-yl]-9-phenylcarbazole
CID 137402190
2-[3-carbazol-9-yl-5-(9,9-dimethylfluoren-2-yl)phenyl]-9-(3-phenylphenyl)carbazole;2-[3-carbazol-9-yl-5-(4-phenylphenyl)phenyl]-9-(3-phenylphenyl)carbazole;2-[3-(3-phenylcarbazol-9-yl)-5-(4-phenylphenyl)phenyl]-9-(3-phenylphenyl)carbazole
CID 159307111
3-[3-(9,9-dimethylfluoren-2-yl)-5-triphenylen-2-ylphenyl]-6,9-diphenylcarbazole;9-phenyl-3-[3-(3-phenylphenyl)-5-triphenylen-2-ylphenyl]carbazole;9-phenyl-3-[3-(4-phenylphenyl)-5-triphenylen-2-ylphenyl]carbazole
CID 161477367
5-[3-[3-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)carbazol-9-yl]phenyl]-1-azapentacyclo[10.7.1.02,7.08,20.013,18]icosa-2(7),3,5,8,10,12(20),13,15,17-nonaen-19-one
CID 154952080
9-[6-[4-[6-(9,9-dimethylfluoren-2-yl)-2-phenylpyrimidin-4-yl]phenyl]-2-pyridinyl]carbazole
CID 67678292

Frequently Asked Questions

What is the IUPAC name of 4-[9-[3-(9,9-dimethylfluoren-2-yl)phenyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-[3-(9,9-dimethylfluoren-3-yl)phenyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-[6-(9,9-dimethylfluoren-2-yl)-2-pyridinyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-[6-(9,9-dimethylfluoren-3-yl)-2-pyridinyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-(3-triphenylen-2-ylphenyl)carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-(6-triphenylen-2-yl-2-pyridinyl)carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene?
The IUPAC name of 4-[9-[3-(9,9-dimethylfluoren-2-yl)phenyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-[3-(9,9-dimethylfluoren-3-yl)phenyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-[6-(9,9-dimethylfluoren-2-yl)-2-pyridinyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-[6-(9,9-dimethylfluoren-3-yl)-2-pyridinyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-(3-triphenylen-2-ylphenyl)carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-(6-triphenylen-2-yl-2-pyridinyl)carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene (CID 159986291) is 4-[9-[3-(9,9-dimethylfluoren-2-yl)phenyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-[3-(9,9-dimethylfluoren-3-yl)phenyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-[6-(9,9-dimethylfluoren-2-yl)-2-pyridinyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-[6-(9,9-dimethylfluoren-3-yl)-2-pyridinyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-(3-triphenylen-2-ylphenyl)carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-(6-triphenylen-2-yl-2-pyridinyl)carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene.
What is the SMILES notation for 4-[9-[3-(9,9-dimethylfluoren-2-yl)phenyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-[3-(9,9-dimethylfluoren-3-yl)phenyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-[6-(9,9-dimethylfluoren-2-yl)-2-pyridinyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-[6-(9,9-dimethylfluoren-3-yl)-2-pyridinyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-(3-triphenylen-2-ylphenyl)carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-(6-triphenylen-2-yl-2-pyridinyl)carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene?
The canonical SMILES for 4-[9-[3-(9,9-dimethylfluoren-2-yl)phenyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-[3-(9,9-dimethylfluoren-3-yl)phenyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-[6-(9,9-dimethylfluoren-2-yl)-2-pyridinyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-[6-(9,9-dimethylfluoren-3-yl)-2-pyridinyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-(3-triphenylen-2-ylphenyl)carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-(6-triphenylen-2-yl-2-pyridinyl)carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene is CC1(C)c2ccccc2-c2cc(-c3cccc(-n4c5ccccc5c5cc(-c6ccc7c8cccc9c%10ccccc%10n(c7c6)c98)ccc54)c3)ccc21.CC1(C)c2ccccc2-c2cc(-c3cccc(-n4c5ccccc5c5cc(-c6ccc7c8cccc9c%10ccccc%10n(c7c6)c98)ccc54)n3)ccc21.CC1(C)c2ccccc2-c2ccc(-c3cccc(-n4c5ccccc5c5cc(-c6ccc7c8cccc9c%10ccccc%10n(c7c6)c98)ccc54)c3)cc21.CC1(C)c2ccccc2-c2ccc(-c3cccc(-n4c5ccccc5c5cc(-c6ccc7c8cccc9c%10ccccc%10n(c7c6)c98)ccc54)n3)cc21.c1cc(-c2ccc3c4ccccc4c4ccccc4c3c2)cc(-n2c3ccccc3c3cc(-c4ccc5c6cccc7c8ccccc8n(c5c4)c76)ccc32)c1.c1cc(-c2ccc3c4ccccc4c4ccccc4c3c2)nc(-n2c3ccccc3c3cc(-c4ccc5c6cccc7c8ccccc8n(c5c4)c76)ccc32)c1.
What is the InChIKey of 4-[9-[3-(9,9-dimethylfluoren-2-yl)phenyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-[3-(9,9-dimethylfluoren-3-yl)phenyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-[6-(9,9-dimethylfluoren-2-yl)-2-pyridinyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-[6-(9,9-dimethylfluoren-3-yl)-2-pyridinyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-(3-triphenylen-2-ylphenyl)carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-(6-triphenylen-2-yl-2-pyridinyl)carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene?
The InChIKey is OGJLNEIGXFKOGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C54H32N2.C53H31N3.2C51H34N2.2C50H33N3/c1-2-15-40-38(13-1)39-14-3-4-16-41(39)48-30-34(23-26-42(40)48)33-11-9-12-37(29-33)55-50-21-7-6-18-44(50)49-31-35(25-28-52(49)55)36-24-27-45-47-20-10-19-46-43-17-5-8-22-51(43)56(54(46)47)53(45)32-36;1-2-13-37-35(11-1)36-12-3-4-14-38(36)45-30-34(24-26-39(37)45)47-19-10-22-52(54-47)55-48-20-7-6-16-41(48)46-29-32(25-28-50(46)55)33-23-27-42-44-18-9-17-43-40-15-5-8-21-49(40)56(53(43)44)51(42)31-33;1-51(2)44-18-6-3-13-36(44)37-24-21-33(29-45(37)51)31-11-9-12-35(27-31)52-46-19-7-5-15-39(46)43-28-32(23-26-48(43)52)34-22-25-40-42-17-10-16-41-38-14-4-8-20-47(38)53(50(41)42)49(40)30-34;1-51(2)44-18-6-3-13-36(44)42-28-32(22-25-45(42)51)31-11-9-12-35(27-31)52-46-19-7-5-15-38(46)43-29-33(23-26-48(43)52)34-21-24-39-41-17-10-16-40-37-14-4-8-20-47(37)53(50(40)41)49(39)30-34;1-50(2)41-16-6-3-11-33(41)34-24-22-32(28-42(34)50)43-17-10-20-48(51-43)52-44-18-7-5-13-36(44)40-27-30(23-26-46(40)52)31-21-25-37-39-15-9-14-38-35-12-4-8-19-45(35)53(49(38)39)47(37)29-31;1-50(2)41-16-6-3-11-33(41)39-28-32(22-25-42(39)50)43-17-10-20-48(51-43)52-44-18-7-5-13-35(44)40-27-30(23-26-46(40)52)31-21-24-36-38-15-9-14-37-34-12-4-8-19-45(34)53(49(37)38)47(36)29-31/h1-32H;1-31H;2*3-30H,1-2H3;2*3-29H,1-2H3.
What are the key properties of 4-[9-[3-(9,9-dimethylfluoren-2-yl)phenyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-[3-(9,9-dimethylfluoren-3-yl)phenyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-[6-(9,9-dimethylfluoren-2-yl)-2-pyridinyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-[6-(9,9-dimethylfluoren-3-yl)-2-pyridinyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-(3-triphenylen-2-ylphenyl)carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-(6-triphenylen-2-yl-2-pyridinyl)carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene?
4-[9-[3-(9,9-dimethylfluoren-2-yl)phenyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-[3-(9,9-dimethylfluoren-3-yl)phenyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-[6-(9,9-dimethylfluoren-2-yl)-2-pyridinyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-[6-(9,9-dimethylfluoren-3-yl)-2-pyridinyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-(3-triphenylen-2-ylphenyl)carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-(6-triphenylen-2-yl-2-pyridinyl)carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene has a molecular weight of 4120.08 g/mol, XLogP of 81.94, 18 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[9-[3-(9,9-dimethylfluoren-2-yl)phenyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-[3-(9,9-dimethylfluoren-3-yl)phenyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-[6-(9,9-dimethylfluoren-2-yl)-2-pyridinyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-[6-(9,9-dimethylfluoren-3-yl)-2-pyridinyl]carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-(3-triphenylen-2-ylphenyl)carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene;4-[9-(6-triphenylen-2-yl-2-pyridinyl)carbazol-3-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene is sourced from PubChem (CID 159986291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).