2-[4-[4-(7-phenylbenzo[c]carbazol-10-yl)carbazol-9-yl]phenyl]quinoline-4-carbonitrile;2-[4-[4-(7-phenylbenzo[g]carbazol-9-yl)carbazol-9-yl]phenyl]quinazoline-4-carbonitrile

C99H59N9 — CID 162155055

IUPAC2-[4-[4-(7-phenylbenzo[c]carbazol-10-yl)carbazol-9-yl]phenyl]quinoline-4-carbonitrile;2-[4-[4-(7-phenylbenzo[g]carbazol-9-yl)carbazol-9-yl]phenyl]quinazoline-4-carbonitrile
SMILESN#Cc1cc(-c2ccc(-n3c4ccccc4c4c(-c5ccc6c(c5)c5c7ccccc7ccc5n6-c5ccccc5)cccc43)cc2)nc2ccccc12.N#Cc1nc(-c2ccc(-n3c4ccccc4c4c(-c5ccc6c7c8ccccc8ccc7n(-c7ccccc7)c6c5)cccc43)cc2)nc2ccccc12
InChIInChI=1S/C50H30N4.C49H29N5/c51-31-35-30-44(52-43-18-8-6-14-38(35)43)33-21-25-37(26-22-33)54-45-19-9-7-16-41(45)49-40(17-10-20-47(49)54)34-24-27-46-42(29-34)50-39-15-5-4-11-32(39)23-28-48(50)53(46)36-12-2-1-3-13-36;50-30-42-38-15-6-8-18-41(38)51-49(52-42)32-21-25-35(26-22-32)53-43-19-9-7-16-39(43)48-37(17-10-20-44(48)53)33-23-27-40-46(29-33)54(34-12-2-1-3-13-34)45-28-24-31-11-4-5-14-36(31)47(40)45/h1-30H;1-29H
InChIKeyZLSCBJXLESFLBW-UHFFFAOYSA-N
MW1374.62 g/mol
LogP24.97
Rot. Bonds8

About 2-[4-[4-(7-phenylbenzo[c]carbazol-10-yl)carbazol-9-yl]phenyl]quinoline-4-carbonitrile;2-[4-[4-(7-phenylbenzo[g]carbazol-9-yl)carbazol-9-yl]phenyl]quinazoline-4-carbonitrile

2-[4-[4-(7-phenylbenzo[c]carbazol-10-yl)carbazol-9-yl]phenyl]quinoline-4-carbonitrile;2-[4-[4-(7-phenylbenzo[g]carbazol-9-yl)carbazol-9-yl]phenyl]quinazoline-4-carbonitrile (PubChem CID 162155055) has the molecular formula C99H59N9 and a molecular weight of 1374.62 g/mol. Its IUPAC name is 2-[4-[4-(7-phenylbenzo[c]carbazol-10-yl)carbazol-9-yl]phenyl]quinoline-4-carbonitrile;2-[4-[4-(7-phenylbenzo[g]carbazol-9-yl)carbazol-9-yl]phenyl]quinazoline-4-carbonitrile.

Molecular Properties

Compound Name2-[4-[4-(7-phenylbenzo[c]carbazol-10-yl)carbazol-9-yl]phenyl]quinoline-4-carbonitrile;2-[4-[4-(7-phenylbenzo[g]carbazol-9-yl)carbazol-9-yl]phenyl]quinazoline-4-carbonitrile
PubChem CID162155055
Molecular FormulaC99H59N9
Molecular Weight1374.62 g/mol
Exact Mass1373.49
IUPAC Name2-[4-[4-(7-phenylbenzo[c]carbazol-10-yl)carbazol-9-yl]phenyl]quinoline-4-carbonitrile;2-[4-[4-(7-phenylbenzo[g]carbazol-9-yl)carbazol-9-yl]phenyl]quinazoline-4-carbonitrile
SMILESN#Cc1cc(-c2ccc(-n3c4ccccc4c4c(-c5ccc6c(c5)c5c7ccccc7ccc5n6-c5ccccc5)cccc43)cc2)nc2ccccc12.N#Cc1nc(-c2ccc(-n3c4ccccc4c4c(-c5ccc6c7c8ccccc8ccc7n(-c7ccccc7)c6c5)cccc43)cc2)nc2ccccc12
InChIInChI=1S/C50H30N4.C49H29N5/c51-31-35-30-44(52-43-18-8-6-14-38(35)43)33-21-25-37(26-22-33)54-45-19-9-7-16-41(45)49-40(17-10-20-47(49)54)34-24-27-46-42(29-34)50-39-15-5-4-11-32(39)23-28-48(50)53(46)36-12-2-1-3-13-36;50-30-42-38-15-6-8-18-41(38)51-49(52-42)32-21-25-35(26-22-32)53-43-19-9-7-16-39(43)48-37(17-10-20-44(48)53)33-23-27-40-46(29-33)54(34-12-2-1-3-13-34)45-28-24-31-11-4-5-14-36(31)47(40)45/h1-30H;1-29H
InChIKeyZLSCBJXLESFLBW-UHFFFAOYSA-N
XLogP24.97
TPSA105.97 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds8
Heavy Atoms108
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001374.62
LogP ≤ 524.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Analyze 2-[4-[4-(7-phenylbenzo[c]carbazol-10-yl)carbazol-9-yl]phenyl]quinoline-4-carbonitrile;2-[4-[4-(7-phenylbenzo[g]carbazol-9-yl)carbazol-9-yl]phenyl]quinazoline-4-carbonitrile with MolForge

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Related Compounds

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
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
3-[9-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazol-4-yl]-9-phenylcarbazole
CID 118528300
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-(7,7-dimethylbenzo[c]fluoren-10-yl)carbazol-9-yl]quinazoline-4-carbonitrile;2-[3-(9,9-dimethylfluoren-3-yl)carbazol-9-yl]-7-fluoroquinoline-4-carbonitrile;2-[4-(4-phenanthren-3-ylcarbazol-9-yl)phenyl]quinazoline-4-carbonitrile;2-[4-(4-phenanthren-3-ylcarbazol-9-yl)phenyl]quinoline-4-carbonitrile
CID 159756016
5-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]-9-phenyl-3-[9-phenyl-7-[4-[6-phenyl-2-[3-[9-phenyl-7-(9-phenylcarbazol-2-yl)carbazol-4-yl]phenyl]pyrimidin-4-yl]phenyl]carbazol-3-yl]carbazole
CID 155039415
9-[4-[3-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-7-phenylbenzo[c]carbazole;10-[4-[3-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-7-phenylbenzo[c]carbazole;5-[4-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-6-phenylpyrimidin-2-yl]-7-phenylbenzo[c]carbazole;9-[4-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-6-phenylpyrimidin-2-yl]-7-phenylbenzo[c]carbazole;9-[6-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-2-phenylpyrimidin-4-yl]-7-phenylbenzo[c]carbazole;10-[4-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-6-phenylpyrimidin-2-yl]-7-phenylbenzo[c]carbazole;10-[6-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-2-phenylpyrimidin-4-yl]-7-phenylbenzo[c]carbazole
CID 159515250
4-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-9-[4-(9-phenylcarbazol-4-yl)phenyl]carbazole
CID 121306271
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
6-[9-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazol-2-yl]-2-[9-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]-5-(9-phenylcarbazol-3-yl)carbazol-3-yl]-9-phenylcarbazole
CID 134590951
9-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-5-(9-phenylcarbazol-3-yl)pyrido[3,4-b]indole;10-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-4-yl]-7-phenylbenzo[c]carbazole;6-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-4-yl]-9-phenylpyrido[3,4-b]indole
CID 160795339
2-[4-[3-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazol-9-yl]phenyl]-9-phenylcarbazole;3-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]-9-[4-(9-phenylcarbazol-4-yl)phenyl]carbazole
CID 157082857

Frequently Asked Questions

What is the IUPAC name of 2-[4-[4-(7-phenylbenzo[c]carbazol-10-yl)carbazol-9-yl]phenyl]quinoline-4-carbonitrile;2-[4-[4-(7-phenylbenzo[g]carbazol-9-yl)carbazol-9-yl]phenyl]quinazoline-4-carbonitrile?
The IUPAC name of 2-[4-[4-(7-phenylbenzo[c]carbazol-10-yl)carbazol-9-yl]phenyl]quinoline-4-carbonitrile;2-[4-[4-(7-phenylbenzo[g]carbazol-9-yl)carbazol-9-yl]phenyl]quinazoline-4-carbonitrile (CID 162155055) is 2-[4-[4-(7-phenylbenzo[c]carbazol-10-yl)carbazol-9-yl]phenyl]quinoline-4-carbonitrile;2-[4-[4-(7-phenylbenzo[g]carbazol-9-yl)carbazol-9-yl]phenyl]quinazoline-4-carbonitrile.
What is the SMILES notation for 2-[4-[4-(7-phenylbenzo[c]carbazol-10-yl)carbazol-9-yl]phenyl]quinoline-4-carbonitrile;2-[4-[4-(7-phenylbenzo[g]carbazol-9-yl)carbazol-9-yl]phenyl]quinazoline-4-carbonitrile?
The canonical SMILES for 2-[4-[4-(7-phenylbenzo[c]carbazol-10-yl)carbazol-9-yl]phenyl]quinoline-4-carbonitrile;2-[4-[4-(7-phenylbenzo[g]carbazol-9-yl)carbazol-9-yl]phenyl]quinazoline-4-carbonitrile is N#Cc1cc(-c2ccc(-n3c4ccccc4c4c(-c5ccc6c(c5)c5c7ccccc7ccc5n6-c5ccccc5)cccc43)cc2)nc2ccccc12.N#Cc1nc(-c2ccc(-n3c4ccccc4c4c(-c5ccc6c7c8ccccc8ccc7n(-c7ccccc7)c6c5)cccc43)cc2)nc2ccccc12.
What is the InChIKey of 2-[4-[4-(7-phenylbenzo[c]carbazol-10-yl)carbazol-9-yl]phenyl]quinoline-4-carbonitrile;2-[4-[4-(7-phenylbenzo[g]carbazol-9-yl)carbazol-9-yl]phenyl]quinazoline-4-carbonitrile?
The InChIKey is ZLSCBJXLESFLBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C50H30N4.C49H29N5/c51-31-35-30-44(52-43-18-8-6-14-38(35)43)33-21-25-37(26-22-33)54-45-19-9-7-16-41(45)49-40(17-10-20-47(49)54)34-24-27-46-42(29-34)50-39-15-5-4-11-32(39)23-28-48(50)53(46)36-12-2-1-3-13-36;50-30-42-38-15-6-8-18-41(38)51-49(52-42)32-21-25-35(26-22-32)53-43-19-9-7-16-39(43)48-37(17-10-20-44(48)53)33-23-27-40-46(29-33)54(34-12-2-1-3-13-34)45-28-24-31-11-4-5-14-36(31)47(40)45/h1-30H;1-29H.
What are the key properties of 2-[4-[4-(7-phenylbenzo[c]carbazol-10-yl)carbazol-9-yl]phenyl]quinoline-4-carbonitrile;2-[4-[4-(7-phenylbenzo[g]carbazol-9-yl)carbazol-9-yl]phenyl]quinazoline-4-carbonitrile?
2-[4-[4-(7-phenylbenzo[c]carbazol-10-yl)carbazol-9-yl]phenyl]quinoline-4-carbonitrile;2-[4-[4-(7-phenylbenzo[g]carbazol-9-yl)carbazol-9-yl]phenyl]quinazoline-4-carbonitrile has a molecular weight of 1374.62 g/mol, XLogP of 24.97, 8 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[4-(7-phenylbenzo[c]carbazol-10-yl)carbazol-9-yl]phenyl]quinoline-4-carbonitrile;2-[4-[4-(7-phenylbenzo[g]carbazol-9-yl)carbazol-9-yl]phenyl]quinazoline-4-carbonitrile is sourced from PubChem (CID 162155055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).