6-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]-[1]benzofuro[3,2-d]pyrimidine;8-[3-(9-phenylcarbazol-3-yl)-9H-carbazol-1-yl]-[1]benzofuro[3,2-d]pyrimidine;6-[4-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-[1]benzothiolo[3,2-d]pyrimidine;4-phenyl-2-[4-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-[1]benzothiolo[2,3-d]pyrimidine

C178H108N16O2S2 — CID 159105206

IUPAC6-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]-[1]benzofuro[3,2-d]pyrimidine;8-[3-(9-phenylcarbazol-3-yl)-9H-carbazol-1-yl]-[1]benzofuro[3,2-d]pyrimidine;6-[4-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-[1]benzothiolo[3,2-d]pyrimidine;4-phenyl-2-[4-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-[1]benzothiolo[2,3-d]pyrimidine
SMILESc1ccc(-c2nc(-c3ccc(-n4c5ccccc5c5cc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)ccc54)cc3)nc3sc4ccccc4c23)cc1.c1ccc(-n2c3ccccc3c3cc(-c4cc(-c5ccc6oc7cncnc7c6c5)c5[nH]c6ccccc6c5c4)ccc32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccc(-c5cccc6c5sc5cncnc56)cc4)ccc32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4cccc5c4oc4cncnc45)ccc32)cc1
InChIInChI=1S/C52H32N4S.C46H28N4S.2C40H24N4O/c1-3-13-33(14-4-1)50-49-41-19-9-12-22-48(41)57-52(49)54-51(53-50)34-23-27-38(28-24-34)56-45-21-11-8-18-40(45)43-32-36(26-30-47(43)56)35-25-29-46-42(31-35)39-17-7-10-20-44(39)55(46)37-15-5-2-6-16-37;1-2-9-32(10-3-1)49-40-15-6-4-11-35(40)38-25-30(19-23-42(38)49)31-20-24-43-39(26-31)36-12-5-7-16-41(36)50(43)33-21-17-29(18-22-33)34-13-8-14-37-45-44(51-46(34)37)27-47-28-48-45;1-2-9-27(10-3-1)43-33-14-6-4-11-28(33)31-21-25(17-19-35(31)43)26-18-20-36-32(22-26)29-12-5-7-15-34(29)44(36)37-16-8-13-30-39-38(45-40(30)37)23-41-24-42-39;1-2-8-27(9-3-1)44-35-13-7-5-11-29(35)31-18-24(14-16-36(31)44)26-20-30(39-32(21-26)28-10-4-6-12-34(28)43-39)25-15-17-37-33(19-25)40-38(45-37)22-41-23-42-40/h1-32H;1-28H;1-24H;1-23,43H
InChIKeyKDUITKUAAANSEH-UHFFFAOYSA-N
MW2567.07 g/mol
LogP47.09
Rot. Bonds15

About 6-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]-[1]benzofuro[3,2-d]pyrimidine;8-[3-(9-phenylcarbazol-3-yl)-9H-carbazol-1-yl]-[1]benzofuro[3,2-d]pyrimidine;6-[4-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-[1]benzothiolo[3,2-d]pyrimidine;4-phenyl-2-[4-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-[1]benzothiolo[2,3-d]pyrimidine

6-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]-[1]benzofuro[3,2-d]pyrimidine;8-[3-(9-phenylcarbazol-3-yl)-9H-carbazol-1-yl]-[1]benzofuro[3,2-d]pyrimidine;6-[4-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-[1]benzothiolo[3,2-d]pyrimidine;4-phenyl-2-[4-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-[1]benzothiolo[2,3-d]pyrimidine (PubChem CID 159105206) has the molecular formula C178H108N16O2S2 and a molecular weight of 2567.07 g/mol. Its IUPAC name is 6-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]-[1]benzofuro[3,2-d]pyrimidine;8-[3-(9-phenylcarbazol-3-yl)-9H-carbazol-1-yl]-[1]benzofuro[3,2-d]pyrimidine;6-[4-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-[1]benzothiolo[3,2-d]pyrimidine;4-phenyl-2-[4-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-[1]benzothiolo[2,3-d]pyrimidine.

Molecular Properties

Compound Name6-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]-[1]benzofuro[3,2-d]pyrimidine;8-[3-(9-phenylcarbazol-3-yl)-9H-carbazol-1-yl]-[1]benzofuro[3,2-d]pyrimidine;6-[4-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-[1]benzothiolo[3,2-d]pyrimidine;4-phenyl-2-[4-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-[1]benzothiolo[2,3-d]pyrimidine
PubChem CID159105206
Molecular FormulaC178H108N16O2S2
Molecular Weight2567.07 g/mol
Exact Mass2564.83
IUPAC Name6-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]-[1]benzofuro[3,2-d]pyrimidine;8-[3-(9-phenylcarbazol-3-yl)-9H-carbazol-1-yl]-[1]benzofuro[3,2-d]pyrimidine;6-[4-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-[1]benzothiolo[3,2-d]pyrimidine;4-phenyl-2-[4-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-[1]benzothiolo[2,3-d]pyrimidine
SMILESc1ccc(-c2nc(-c3ccc(-n4c5ccccc5c5cc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)ccc54)cc3)nc3sc4ccccc4c23)cc1.c1ccc(-n2c3ccccc3c3cc(-c4cc(-c5ccc6oc7cncnc7c6c5)c5[nH]c6ccccc6c5c4)ccc32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccc(-c5cccc6c5sc5cncnc56)cc4)ccc32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4cccc5c4oc4cncnc45)ccc32)cc1
InChIInChI=1S/C52H32N4S.C46H28N4S.2C40H24N4O/c1-3-13-33(14-4-1)50-49-41-19-9-12-22-48(41)57-52(49)54-51(53-50)34-23-27-38(28-24-34)56-45-21-11-8-18-40(45)43-32-36(26-30-47(43)56)35-25-29-46-42(31-35)39-17-7-10-20-44(39)55(46)37-15-5-2-6-16-37;1-2-9-32(10-3-1)49-40-15-6-4-11-35(40)38-25-30(19-23-42(38)49)31-20-24-43-39(26-31)36-12-5-7-16-41(36)50(43)33-21-17-29(18-22-33)34-13-8-14-37-45-44(51-46(34)37)27-47-28-48-45;1-2-9-27(10-3-1)43-33-14-6-4-11-28(33)31-21-25(17-19-35(31)43)26-18-20-36-32(22-26)29-12-5-7-15-34(29)44(36)37-16-8-13-30-39-38(45-40(30)37)23-41-24-42-39;1-2-8-27(9-3-1)44-35-13-7-5-11-29(35)31-18-24(14-16-36(31)44)26-20-30(39-32(21-26)28-10-4-6-12-34(28)43-39)25-15-17-37-33(19-25)40-38(45-37)22-41-23-42-40/h1-32H;1-28H;1-24H;1-23,43H
InChIKeyKDUITKUAAANSEH-UHFFFAOYSA-N
XLogP47.09
TPSA179.70 Ų
H-Bond Donors1
H-Bond Acceptors19
Rotatable Bonds15
Heavy Atoms198
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002567.07
LogP ≤ 547.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1019

Analyze 6-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]-[1]benzofuro[3,2-d]pyrimidine;8-[3-(9-phenylcarbazol-3-yl)-9H-carbazol-1-yl]-[1]benzofuro[3,2-d]pyrimidine;6-[4-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-[1]benzothiolo[3,2-d]pyrimidine;4-phenyl-2-[4-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-[1]benzothiolo[2,3-d]pyrimidine with MolForge

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Related Compounds

2,6-Bis([1]benzofuro[2,3-a]carbazol-12-yl)-4-[2-(trifluoromethyl)phenyl]benzonitrile;2,6-bis([1]benzofuro[3,2-a]carbazol-12-yl)-4-[2-(trifluoromethyl)phenyl]benzonitrile;2,6-bis([1]benzothiolo[3,2-a]carbazol-12-yl)-4-[2-(trifluoromethyl)phenyl]benzonitrile;2,6-bis[2,7-di(pyrimidin-2-yl)carbazol-9-yl]-4-[2-(trifluoromethyl)phenyl]benzonitrile;2,6-bis[3,6-di(pyrimidin-2-yl)carbazol-9-yl]-4-[2-(trifluoromethyl)phenyl]benzonitrile;2,6-bis[2-(6-phenyl-2-pyridinyl)carbazol-9-yl]-4-[2-(trifluoromethyl)phenyl]benzonitrile;2,6-bis(2-pyrimidin-2-ylcarbazol-9-yl)-4-[2-(trifluoromethyl)phenyl]benzonitrile;2,6-bis(3-pyrimidin-2-ylcarbazol-9-yl)-4-[2-(trifluoromethyl)phenyl]benzonitrile
CID 157432745
1-cyclohexyl-3-propan-2-ylbenzene;1-cyclopentyl-3-propan-2-ylbenzene;2-methyl-4-propan-2-ylpyridine;2-methyl-6-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;2-propan-2-yl-1H-benzimidazole;2-propan-2-yl-1-benzofuran;2-propan-2-yl-1,3-benzothiazole;2-propan-2-yl-1-benzothiophene;2-propan-2-yl-1,3-benzoxazole;2-propan-2-ylimidazo[1,2-a]pyridine;1-propan-2-ylisoquinoline;3-propan-2-ylisoquinoline;1-(2-propan-2-ylphenyl)pyrrolidine;2-propan-2-ylquinazoline;3-propan-2-ylquinoline;4-propan-2-ylquinoline;2-propan-2-ylquinoxaline;2-propan-2-yl-3-(trifluoromethyl)pyridine
CID 157464689
3-[3,5-Bis([1]benzofuro[2,3-a]carbazol-12-yl)-4-(trifluoromethyl)phenyl]benzonitrile;3-[3,5-bis([1]benzofuro[3,2-a]carbazol-12-yl)-4-(trifluoromethyl)phenyl]benzonitrile;3-[3,5-bis([1]benzothiolo[2,3-a]carbazol-12-yl)-4-(trifluoromethyl)phenyl]benzonitrile;3-[3,5-bis([1]benzothiolo[3,2-a]carbazol-12-yl)-4-(trifluoromethyl)phenyl]benzonitrile;9-[5-(3-isocyanophenyl)-3-(2-pyrimidin-2-ylcarbazol-9-yl)-2-(trifluoromethyl)phenyl]-2-pyrimidin-2-ylcarbazole
CID 159453971
2,6-Bis([1]benzofuro[3,2-a]carbazol-12-yl)-4-(2-cyano-6-methylphenyl)benzonitrile;2,6-bis([1]benzofuro[2,3-a]carbazol-12-yl)-4-[2-isocyano-6-(trifluoromethyl)phenyl]benzonitrile;2,6-bis([1]benzothiolo[3,2-a]carbazol-12-yl)-4-[2-isocyano-6-(trifluoromethyl)phenyl]benzonitrile;4-[2-isocyano-6-(trifluoromethyl)phenyl]-2,6-bis(2-pyrimidin-2-ylcarbazol-9-yl)benzonitrile
CID 159561087
9-[4-[4-(4-Dibenzofuran-2-ylphenyl)-6-(9,9-dimethylfluoren-2-yl)pyrimidin-2-yl]phenyl]carbazole;9-(4-dibenzothiophen-2-yl-6-phenylpyrimidin-2-yl)carbazole;9-(4-dibenzothiophen-4-yl-6-phenylpyrimidin-2-yl)carbazole;8-[4-[4-phenyl-6-[4-(9-phenylcarbazol-3-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-3-(trifluoromethyl)-[1]benzofuro[3,2-b]pyridine
CID 160034025
3,5-Bis([1]benzofuro[2,3-a]carbazol-12-yl)-4-[2-isocyano-6-(trifluoromethyl)phenyl]benzonitrile;3,5-bis([1]benzofuro[3,2-a]carbazol-12-yl)-4-[2-isocyano-6-(trifluoromethyl)phenyl]benzonitrile;3,5-bis([1]benzothiolo[3,2-a]carbazol-12-yl)-4-[2-isocyano-6-(trifluoromethyl)phenyl]benzonitrile;4-[2-isocyano-6-(trifluoromethyl)phenyl]-3,5-bis(3-pyrimidin-2-ylcarbazol-9-yl)benzonitrile;4-[2-isocyano-6-(trifluoromethyl)phenyl]-3-(2-pyridin-2-ylcarbazol-9-yl)-5-(2-pyrimidin-2-ylcarbazol-9-yl)benzonitrile
CID 160533362
12-[3-([1]Benzofuro[2,3-a]carbazol-12-yl)-2-isocyano-4-[2-isocyano-6-(trifluoromethyl)phenyl]phenyl]-[1]benzofuro[2,3-a]carbazole;2,6-bis([1]benzofuro[3,2-a]carbazol-12-yl)-3-[2-isocyano-6-(trifluoromethyl)phenyl]benzonitrile;2,6-bis([1]benzothiolo[3,2-a]carbazol-12-yl)-3-[2-isocyano-6-(trifluoromethyl)phenyl]benzonitrile;9-[3-[2,7-di(pyrimidin-2-yl)carbazol-9-yl]-2-isocyano-4-[2-isocyano-6-(trifluoromethyl)phenyl]phenyl]-2,7-di(pyrimidin-2-yl)carbazole;9-[2-isocyano-4-[2-isocyano-6-(trifluoromethyl)phenyl]-3-(3-pyrimidin-2-ylcarbazol-9-yl)phenyl]-3-pyrimidin-2-ylcarbazole;3-[2-isocyano-6-(trifluoromethyl)phenyl]-2,6-bis(2-pyrimidin-2-ylcarbazol-9-yl)benzonitrile
CID 160542497
3,5-Bis([1]benzofuro[2,3-a]carbazol-12-yl)-4-(3-cyano-5-methylphenyl)benzonitrile;3,5-bis([1]benzofuro[3,2-a]carbazol-12-yl)-4-(3-cyano-5-methylphenyl)benzonitrile;3,5-bis([1]benzothiolo[3,2-a]carbazol-12-yl)-4-(3-cyano-5-methylphenyl)benzonitrile;4-[3-isocyano-5-(trifluoromethyl)phenyl]-3,5-bis(2-pyrimidin-2-ylcarbazol-9-yl)benzonitrile
CID 161414512
5-[[4-[4-(1,1-difluoroethyl)-2-pyridinyl]pyrimidin-2-yl]amino]-N,N-dimethyl-1H-indole-2-carboxamide;5-[[4-(4-methoxy-2-pyridinyl)pyrimidin-2-yl]amino]-N,N-dimethyl-1H-indole-2-carbothioamide;2-pyridin-2-yl-N-(4-pyridin-2-ylpyrimidin-2-yl)-3H-indol-6-amine;6-[(4-pyridin-2-ylpyrimidin-2-yl)amino]-3H-1-benzofuran-2-one;6-[(4-pyridin-2-ylpyrimidin-2-yl)amino]-3H-1-benzothiophen-2-one;N-(4-pyridin-2-ylpyrimidin-2-yl)-2-thiophen-2-yl-1,3-benzoxazol-6-amine
CID 161547685
N-[3-[[4-(1-benzofuran-2-yl)-5H-pyrrolo[3,2-d]pyrimidin-2-yl]methyl]phenyl]-3-(trifluoromethyl)benzamide;N-[3-[[4-(1-benzothiophen-2-yl)-5H-pyrrolo[3,2-d]pyrimidin-2-yl]methyl]phenyl]-3-(trifluoromethyl)benzamide;N-[3-[[4-(furan-2-yl)-5H-pyrrolo[3,2-d]pyrimidin-2-yl]methyl]phenyl]-3-(trifluoromethyl)benzamide;N-[3-[(4-thiophen-2-yl-5H-pyrrolo[3,2-d]pyrimidin-2-yl)methyl]phenyl]-3-(trifluoromethyl)benzamide
CID 161678402
4-[8-amino-1-(4-methyl-1-benzofuran-2-yl)imidazo[1,5-a]pyrazin-3-yl]-N,N-dimethylpiperidine-1-carboxamide;4-[8-amino-1-(7-methyl-1-benzothiophen-2-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexane-1-carboxamide;[4-[8-amino-1-[7-(1,3-thiazol-2-yl)-1H-indol-2-yl]imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methanol
CID 91153354
4-[8-amino-1-(4-methyl-1-benzofuran-2-yl)imidazo[1,5-a]pyrazin-3-yl]-N,N-dimethylpiperidine-1-carboxamide;4-[8-amino-1-(7-methyl-1-benzothiophen-2-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexane-1-carboxamide;4-[8-amino-1-[7-(1,3-thiazol-2-yl)-1H-indol-2-yl]imidazo[1,5-a]pyrazin-3-yl]cyclohexane-1-carboxylic acid;[4-[8-amino-1-[7-(1,3-thiazol-2-yl)-1H-indol-2-yl]imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methanol
CID 91229474

Frequently Asked Questions

What is the IUPAC name of 6-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]-[1]benzofuro[3,2-d]pyrimidine;8-[3-(9-phenylcarbazol-3-yl)-9H-carbazol-1-yl]-[1]benzofuro[3,2-d]pyrimidine;6-[4-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-[1]benzothiolo[3,2-d]pyrimidine;4-phenyl-2-[4-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-[1]benzothiolo[2,3-d]pyrimidine?
The IUPAC name of 6-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]-[1]benzofuro[3,2-d]pyrimidine;8-[3-(9-phenylcarbazol-3-yl)-9H-carbazol-1-yl]-[1]benzofuro[3,2-d]pyrimidine;6-[4-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-[1]benzothiolo[3,2-d]pyrimidine;4-phenyl-2-[4-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-[1]benzothiolo[2,3-d]pyrimidine (CID 159105206) is 6-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]-[1]benzofuro[3,2-d]pyrimidine;8-[3-(9-phenylcarbazol-3-yl)-9H-carbazol-1-yl]-[1]benzofuro[3,2-d]pyrimidine;6-[4-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-[1]benzothiolo[3,2-d]pyrimidine;4-phenyl-2-[4-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-[1]benzothiolo[2,3-d]pyrimidine.
What is the SMILES notation for 6-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]-[1]benzofuro[3,2-d]pyrimidine;8-[3-(9-phenylcarbazol-3-yl)-9H-carbazol-1-yl]-[1]benzofuro[3,2-d]pyrimidine;6-[4-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-[1]benzothiolo[3,2-d]pyrimidine;4-phenyl-2-[4-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-[1]benzothiolo[2,3-d]pyrimidine?
The canonical SMILES for 6-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]-[1]benzofuro[3,2-d]pyrimidine;8-[3-(9-phenylcarbazol-3-yl)-9H-carbazol-1-yl]-[1]benzofuro[3,2-d]pyrimidine;6-[4-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-[1]benzothiolo[3,2-d]pyrimidine;4-phenyl-2-[4-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-[1]benzothiolo[2,3-d]pyrimidine is c1ccc(-c2nc(-c3ccc(-n4c5ccccc5c5cc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)ccc54)cc3)nc3sc4ccccc4c23)cc1.c1ccc(-n2c3ccccc3c3cc(-c4cc(-c5ccc6oc7cncnc7c6c5)c5[nH]c6ccccc6c5c4)ccc32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccc(-c5cccc6c5sc5cncnc56)cc4)ccc32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4cccc5c4oc4cncnc45)ccc32)cc1.
What is the InChIKey of 6-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]-[1]benzofuro[3,2-d]pyrimidine;8-[3-(9-phenylcarbazol-3-yl)-9H-carbazol-1-yl]-[1]benzofuro[3,2-d]pyrimidine;6-[4-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-[1]benzothiolo[3,2-d]pyrimidine;4-phenyl-2-[4-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-[1]benzothiolo[2,3-d]pyrimidine?
The InChIKey is KDUITKUAAANSEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C52H32N4S.C46H28N4S.2C40H24N4O/c1-3-13-33(14-4-1)50-49-41-19-9-12-22-48(41)57-52(49)54-51(53-50)34-23-27-38(28-24-34)56-45-21-11-8-18-40(45)43-32-36(26-30-47(43)56)35-25-29-46-42(31-35)39-17-7-10-20-44(39)55(46)37-15-5-2-6-16-37;1-2-9-32(10-3-1)49-40-15-6-4-11-35(40)38-25-30(19-23-42(38)49)31-20-24-43-39(26-31)36-12-5-7-16-41(36)50(43)33-21-17-29(18-22-33)34-13-8-14-37-45-44(51-46(34)37)27-47-28-48-45;1-2-9-27(10-3-1)43-33-14-6-4-11-28(33)31-21-25(17-19-35(31)43)26-18-20-36-32(22-26)29-12-5-7-15-34(29)44(36)37-16-8-13-30-39-38(45-40(30)37)23-41-24-42-39;1-2-8-27(9-3-1)44-35-13-7-5-11-29(35)31-18-24(14-16-36(31)44)26-20-30(39-32(21-26)28-10-4-6-12-34(28)43-39)25-15-17-37-33(19-25)40-38(45-37)22-41-23-42-40/h1-32H;1-28H;1-24H;1-23,43H.
What are the key properties of 6-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]-[1]benzofuro[3,2-d]pyrimidine;8-[3-(9-phenylcarbazol-3-yl)-9H-carbazol-1-yl]-[1]benzofuro[3,2-d]pyrimidine;6-[4-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-[1]benzothiolo[3,2-d]pyrimidine;4-phenyl-2-[4-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-[1]benzothiolo[2,3-d]pyrimidine?
6-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]-[1]benzofuro[3,2-d]pyrimidine;8-[3-(9-phenylcarbazol-3-yl)-9H-carbazol-1-yl]-[1]benzofuro[3,2-d]pyrimidine;6-[4-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-[1]benzothiolo[3,2-d]pyrimidine;4-phenyl-2-[4-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-[1]benzothiolo[2,3-d]pyrimidine has a molecular weight of 2567.07 g/mol, XLogP of 47.09, 15 rotatable bonds, 1 hydrogen bond donors, and 19 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]-[1]benzofuro[3,2-d]pyrimidine;8-[3-(9-phenylcarbazol-3-yl)-9H-carbazol-1-yl]-[1]benzofuro[3,2-d]pyrimidine;6-[4-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-[1]benzothiolo[3,2-d]pyrimidine;4-phenyl-2-[4-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-[1]benzothiolo[2,3-d]pyrimidine is sourced from PubChem (CID 159105206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).