2-[5-(9-phenylcarbazol-3-yl)benzo[c]carbazol-7-yl]quinazoline-4-carbonitrile;2-[3-(9-phenylcarbazol-2-yl)carbazol-9-yl]-7-pyridin-4-ylquinoline-4-carbonitrile;7-phenyl-2-[3-(9-phenylcarbazol-2-yl)carbazol-9-yl]quinoline-4-carbonitrile

C134H80N14 — CID 162050395

IUPAC2-[5-(9-phenylcarbazol-3-yl)benzo[c]carbazol-7-yl]quinazoline-4-carbonitrile;2-[3-(9-phenylcarbazol-2-yl)carbazol-9-yl]-7-pyridin-4-ylquinoline-4-carbonitrile;7-phenyl-2-[3-(9-phenylcarbazol-2-yl)carbazol-9-yl]quinoline-4-carbonitrile
SMILESN#Cc1cc(-n2c3ccccc3c3cc(-c4ccc5c6ccccc6n(-c6ccccc6)c5c4)ccc32)nc2cc(-c3ccccc3)ccc12.N#Cc1cc(-n2c3ccccc3c3cc(-c4ccc5c6ccccc6n(-c6ccccc6)c5c4)ccc32)nc2cc(-c3ccncc3)ccc12.N#Cc1nc(-n2c3ccccc3c3c4ccccc4c(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc32)nc2ccccc12
InChIInChI=1S/C46H28N4.C45H27N5.C43H25N5/c47-29-34-28-46(48-41-26-32(19-22-36(34)41)30-11-3-1-4-12-30)50-43-18-10-8-16-38(43)40-25-31(21-24-44(40)50)33-20-23-39-37-15-7-9-17-42(37)49(45(39)27-33)35-13-5-2-6-14-35;46-28-33-27-45(48-40-25-31(14-17-35(33)40)29-20-22-47-23-21-29)50-42-13-7-5-11-37(42)39-24-30(16-19-43(39)50)32-15-18-38-36-10-4-6-12-41(36)49(44(38)26-32)34-8-2-1-3-9-34;44-26-37-32-17-6-9-19-36(32)45-43(46-37)48-39-21-11-8-18-33(39)42-31-16-5-4-14-29(31)34(25-41(42)48)27-22-23-40-35(24-27)30-15-7-10-20-38(30)47(40)28-12-2-1-3-13-28/h1-28H;1-27H;1-25H
InChIKeyYYLWZUNBVUXGRO-UHFFFAOYSA-N
MW1886.21 g/mol
LogP33.18
Rot. Bonds11

About 2-[5-(9-phenylcarbazol-3-yl)benzo[c]carbazol-7-yl]quinazoline-4-carbonitrile;2-[3-(9-phenylcarbazol-2-yl)carbazol-9-yl]-7-pyridin-4-ylquinoline-4-carbonitrile;7-phenyl-2-[3-(9-phenylcarbazol-2-yl)carbazol-9-yl]quinoline-4-carbonitrile

2-[5-(9-phenylcarbazol-3-yl)benzo[c]carbazol-7-yl]quinazoline-4-carbonitrile;2-[3-(9-phenylcarbazol-2-yl)carbazol-9-yl]-7-pyridin-4-ylquinoline-4-carbonitrile;7-phenyl-2-[3-(9-phenylcarbazol-2-yl)carbazol-9-yl]quinoline-4-carbonitrile (PubChem CID 162050395) has the molecular formula C134H80N14 and a molecular weight of 1886.21 g/mol. Its IUPAC name is 2-[5-(9-phenylcarbazol-3-yl)benzo[c]carbazol-7-yl]quinazoline-4-carbonitrile;2-[3-(9-phenylcarbazol-2-yl)carbazol-9-yl]-7-pyridin-4-ylquinoline-4-carbonitrile;7-phenyl-2-[3-(9-phenylcarbazol-2-yl)carbazol-9-yl]quinoline-4-carbonitrile.

Molecular Properties

Compound Name2-[5-(9-phenylcarbazol-3-yl)benzo[c]carbazol-7-yl]quinazoline-4-carbonitrile;2-[3-(9-phenylcarbazol-2-yl)carbazol-9-yl]-7-pyridin-4-ylquinoline-4-carbonitrile;7-phenyl-2-[3-(9-phenylcarbazol-2-yl)carbazol-9-yl]quinoline-4-carbonitrile
PubChem CID162050395
Molecular FormulaC134H80N14
Molecular Weight1886.21 g/mol
Exact Mass1884.67
IUPAC Name2-[5-(9-phenylcarbazol-3-yl)benzo[c]carbazol-7-yl]quinazoline-4-carbonitrile;2-[3-(9-phenylcarbazol-2-yl)carbazol-9-yl]-7-pyridin-4-ylquinoline-4-carbonitrile;7-phenyl-2-[3-(9-phenylcarbazol-2-yl)carbazol-9-yl]quinoline-4-carbonitrile
SMILESN#Cc1cc(-n2c3ccccc3c3cc(-c4ccc5c6ccccc6n(-c6ccccc6)c5c4)ccc32)nc2cc(-c3ccccc3)ccc12.N#Cc1cc(-n2c3ccccc3c3cc(-c4ccc5c6ccccc6n(-c6ccccc6)c5c4)ccc32)nc2cc(-c3ccncc3)ccc12.N#Cc1nc(-n2c3ccccc3c3c4ccccc4c(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc32)nc2ccccc12
InChIInChI=1S/C46H28N4.C45H27N5.C43H25N5/c47-29-34-28-46(48-41-26-32(19-22-36(34)41)30-11-3-1-4-12-30)50-43-18-10-8-16-38(43)40-25-31(21-24-44(40)50)33-20-23-39-37-15-7-9-17-42(37)49(45(39)27-33)35-13-5-2-6-14-35;46-28-33-27-45(48-40-25-31(14-17-35(33)40)29-20-22-47-23-21-29)50-42-13-7-5-11-37(42)39-24-30(16-19-43(39)50)32-15-18-38-36-10-4-6-12-41(36)49(44(38)26-32)34-8-2-1-3-9-34;44-26-37-32-17-6-9-19-36(32)45-43(46-37)48-39-21-11-8-18-33(39)42-31-16-5-4-14-29(31)34(25-41(42)48)27-22-23-40-35(24-27)30-15-7-10-20-38(30)47(40)28-12-2-1-3-13-28/h1-28H;1-27H;1-25H
InChIKeyYYLWZUNBVUXGRO-UHFFFAOYSA-N
XLogP33.18
TPSA165.40 Ų
H-Bond Donors
H-Bond Acceptors14
Rotatable Bonds11
Heavy Atoms148
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001886.21
LogP ≤ 533.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1014

Analyze 2-[5-(9-phenylcarbazol-3-yl)benzo[c]carbazol-7-yl]quinazoline-4-carbonitrile;2-[3-(9-phenylcarbazol-2-yl)carbazol-9-yl]-7-pyridin-4-ylquinoline-4-carbonitrile;7-phenyl-2-[3-(9-phenylcarbazol-2-yl)carbazol-9-yl]quinoline-4-carbonitrile with MolForge

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Related Compounds

2-[5-(9-phenylcarbazol-3-yl)benzo[c]carbazol-7-yl]quinazoline-4-carbonitrile;2-[3-[6-phenyl-9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]quinazoline-4-carbonitrile;2-[3-[6-phenyl-9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]quinoline-4-carbonitrile
CID 159941374
2-[10-(7-phenylbenzo[c]carbazol-5-yl)benzo[c]carbazol-7-yl]quinazoline-4-carbonitrile;2-[10-(7-phenylbenzo[c]carbazol-5-yl)benzo[c]carbazol-7-yl]quinoline-4-carbonitrile;2-[10-(7-phenylbenzo[c]carbazol-10-yl)benzo[c]carbazol-7-yl]quinoline-4-carbonitrile
CID 161057241
2-[3-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]-7-pyridin-4-ylquinoline-4-carbonitrile
CID 121337865
7-fluoro-2-[3-(9-phenylcarbazol-2-yl)carbazol-9-yl]quinazoline-4-carbonitrile;2-[2-(9-phenylcarbazol-3-yl)carbazol-9-yl]quinazoline-4-carbonitrile;2-[2-(9-phenylcarbazol-3-yl)carbazol-9-yl]quinoline-4-carbonitrile;3-phenyl-2-[2-(9-phenylcarbazol-3-yl)carbazol-9-yl]quinoline-4-carbonitrile
CID 162228767
2-(10-benzo[c]carbazol-7-ylbenzo[c]carbazol-7-yl)quinazoline-4-carbonitrile;2-[10-(7-phenylbenzo[c]carbazol-10-yl)benzo[c]carbazol-7-yl]quinoline-4-carbonitrile;2-[4-[10-(9-phenylcarbazol-3-yl)benzo[c]carbazol-7-yl]phenyl]quinoline-4-carbonitrile
CID 157146532
7-fluoro-2-[5-(11-phenylbenzo[a]carbazol-8-yl)benzo[c]carbazol-7-yl]quinoline-4-carbonitrile
CID 121337810
7-phenyl-5-[9-[4-(6-phenylnaphthalen-2-yl)quinazolin-2-yl]carbazol-3-yl]benzo[c]carbazole
CID 118637738
2-[10-(7-phenylbenzo[g]carbazol-9-yl)benzo[c]carbazol-7-yl]quinazoline-4-carbonitrile;2-[4-[4-[3-(9-phenylcarbazol-3-yl)phenyl]carbazol-9-yl]phenyl]quinazoline-4-carbonitrile;2-[3-phenyl-6-(11-phenylbenzo[a]carbazol-8-yl)carbazol-9-yl]quinazoline-4-carbonitrile
CID 162048204
5-[3-(9-phenylcarbazol-3-yl)phenyl]-7-(4-phenylquinazolin-2-yl)benzo[c]carbazole
CID 134353255
2-[4-[10-(9,9-dimethylfluoren-2-yl)benzo[c]carbazol-7-yl]phenyl]quinoline-4-carbonitrile;2-[10-(9,9-dimethylfluoren-2-yl)benzo[c]carbazol-7-yl]quinoline-4-carbonitrile;2-[3-(9,9-dimethylfluoren-2-yl)-6-phenylcarbazol-9-yl]quinazoline-4-carbonitrile
CID 158511731
7-[4-(6,9-diphenylcarbazol-3-yl)quinazolin-2-yl]benzo[c]carbazole;7-[4-(9-phenylcarbazol-3-yl)quinazolin-2-yl]benzo[c]carbazole;7-[4-(9-phenylcarbazol-3-yl)quinolin-2-yl]benzo[c]carbazole
CID 158696637
5-(9-phenylcarbazol-2-yl)-7-(4-phenylpyrido[3,2-d]pyrimidin-2-yl)benzo[c]carbazole
CID 118637586

Frequently Asked Questions

What is the IUPAC name of 2-[5-(9-phenylcarbazol-3-yl)benzo[c]carbazol-7-yl]quinazoline-4-carbonitrile;2-[3-(9-phenylcarbazol-2-yl)carbazol-9-yl]-7-pyridin-4-ylquinoline-4-carbonitrile;7-phenyl-2-[3-(9-phenylcarbazol-2-yl)carbazol-9-yl]quinoline-4-carbonitrile?
The IUPAC name of 2-[5-(9-phenylcarbazol-3-yl)benzo[c]carbazol-7-yl]quinazoline-4-carbonitrile;2-[3-(9-phenylcarbazol-2-yl)carbazol-9-yl]-7-pyridin-4-ylquinoline-4-carbonitrile;7-phenyl-2-[3-(9-phenylcarbazol-2-yl)carbazol-9-yl]quinoline-4-carbonitrile (CID 162050395) is 2-[5-(9-phenylcarbazol-3-yl)benzo[c]carbazol-7-yl]quinazoline-4-carbonitrile;2-[3-(9-phenylcarbazol-2-yl)carbazol-9-yl]-7-pyridin-4-ylquinoline-4-carbonitrile;7-phenyl-2-[3-(9-phenylcarbazol-2-yl)carbazol-9-yl]quinoline-4-carbonitrile.
What is the SMILES notation for 2-[5-(9-phenylcarbazol-3-yl)benzo[c]carbazol-7-yl]quinazoline-4-carbonitrile;2-[3-(9-phenylcarbazol-2-yl)carbazol-9-yl]-7-pyridin-4-ylquinoline-4-carbonitrile;7-phenyl-2-[3-(9-phenylcarbazol-2-yl)carbazol-9-yl]quinoline-4-carbonitrile?
The canonical SMILES for 2-[5-(9-phenylcarbazol-3-yl)benzo[c]carbazol-7-yl]quinazoline-4-carbonitrile;2-[3-(9-phenylcarbazol-2-yl)carbazol-9-yl]-7-pyridin-4-ylquinoline-4-carbonitrile;7-phenyl-2-[3-(9-phenylcarbazol-2-yl)carbazol-9-yl]quinoline-4-carbonitrile is N#Cc1cc(-n2c3ccccc3c3cc(-c4ccc5c6ccccc6n(-c6ccccc6)c5c4)ccc32)nc2cc(-c3ccccc3)ccc12.N#Cc1cc(-n2c3ccccc3c3cc(-c4ccc5c6ccccc6n(-c6ccccc6)c5c4)ccc32)nc2cc(-c3ccncc3)ccc12.N#Cc1nc(-n2c3ccccc3c3c4ccccc4c(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc32)nc2ccccc12.
What is the InChIKey of 2-[5-(9-phenylcarbazol-3-yl)benzo[c]carbazol-7-yl]quinazoline-4-carbonitrile;2-[3-(9-phenylcarbazol-2-yl)carbazol-9-yl]-7-pyridin-4-ylquinoline-4-carbonitrile;7-phenyl-2-[3-(9-phenylcarbazol-2-yl)carbazol-9-yl]quinoline-4-carbonitrile?
The InChIKey is YYLWZUNBVUXGRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C46H28N4.C45H27N5.C43H25N5/c47-29-34-28-46(48-41-26-32(19-22-36(34)41)30-11-3-1-4-12-30)50-43-18-10-8-16-38(43)40-25-31(21-24-44(40)50)33-20-23-39-37-15-7-9-17-42(37)49(45(39)27-33)35-13-5-2-6-14-35;46-28-33-27-45(48-40-25-31(14-17-35(33)40)29-20-22-47-23-21-29)50-42-13-7-5-11-37(42)39-24-30(16-19-43(39)50)32-15-18-38-36-10-4-6-12-41(36)49(44(38)26-32)34-8-2-1-3-9-34;44-26-37-32-17-6-9-19-36(32)45-43(46-37)48-39-21-11-8-18-33(39)42-31-16-5-4-14-29(31)34(25-41(42)48)27-22-23-40-35(24-27)30-15-7-10-20-38(30)47(40)28-12-2-1-3-13-28/h1-28H;1-27H;1-25H.
What are the key properties of 2-[5-(9-phenylcarbazol-3-yl)benzo[c]carbazol-7-yl]quinazoline-4-carbonitrile;2-[3-(9-phenylcarbazol-2-yl)carbazol-9-yl]-7-pyridin-4-ylquinoline-4-carbonitrile;7-phenyl-2-[3-(9-phenylcarbazol-2-yl)carbazol-9-yl]quinoline-4-carbonitrile?
2-[5-(9-phenylcarbazol-3-yl)benzo[c]carbazol-7-yl]quinazoline-4-carbonitrile;2-[3-(9-phenylcarbazol-2-yl)carbazol-9-yl]-7-pyridin-4-ylquinoline-4-carbonitrile;7-phenyl-2-[3-(9-phenylcarbazol-2-yl)carbazol-9-yl]quinoline-4-carbonitrile has a molecular weight of 1886.21 g/mol, XLogP of 33.18, 11 rotatable bonds, 0 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(9-phenylcarbazol-3-yl)benzo[c]carbazol-7-yl]quinazoline-4-carbonitrile;2-[3-(9-phenylcarbazol-2-yl)carbazol-9-yl]-7-pyridin-4-ylquinoline-4-carbonitrile;7-phenyl-2-[3-(9-phenylcarbazol-2-yl)carbazol-9-yl]quinoline-4-carbonitrile is sourced from PubChem (CID 162050395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).