10-(9-phenylcarbazol-3-yl)-7-(4-phenylquinazolin-2-yl)-1,2-dihydrobenzo[c]carbazole

C48H32N4 — CID 165155024

IUPAC10-(9-phenylcarbazol-3-yl)-7-(4-phenylquinazolin-2-yl)-1,2-dihydrobenzo[c]carbazole
SMILESC1=Cc2ccc3c(c2CC1)c1cc(-c2ccc4c(c2)c2ccccc2n4-c2ccccc2)ccc1n3-c1nc(-c2ccccc2)c2ccccc2n1
InChIInChI=1S/C48H32N4/c1-3-14-32(15-4-1)47-38-20-9-11-21-41(38)49-48(50-47)52-44-27-25-34(30-40(44)46-36-18-8-7-13-31(36)23-28-45(46)52)33-24-26-43-39(29-33)37-19-10-12-22-42(37)51(43)35-16-5-2-6-17-35/h1-7,9-17,19-30H,8,18H2
InChIKeyRRIIBVBUMLYUGL-UHFFFAOYSA-N
MW664.81 g/mol
LogP12.12
Rot. Bonds4

About 10-(9-phenylcarbazol-3-yl)-7-(4-phenylquinazolin-2-yl)-1,2-dihydrobenzo[c]carbazole

10-(9-phenylcarbazol-3-yl)-7-(4-phenylquinazolin-2-yl)-1,2-dihydrobenzo[c]carbazole (PubChem CID 165155024) has the molecular formula C48H32N4 and a molecular weight of 664.81 g/mol. Its IUPAC name is 10-(9-phenylcarbazol-3-yl)-7-(4-phenylquinazolin-2-yl)-1,2-dihydrobenzo[c]carbazole.

Molecular Properties

Compound Name10-(9-phenylcarbazol-3-yl)-7-(4-phenylquinazolin-2-yl)-1,2-dihydrobenzo[c]carbazole
PubChem CID165155024
Molecular FormulaC48H32N4
Molecular Weight664.81 g/mol
Exact Mass664.26
IUPAC Name10-(9-phenylcarbazol-3-yl)-7-(4-phenylquinazolin-2-yl)-1,2-dihydrobenzo[c]carbazole
SMILESC1=Cc2ccc3c(c2CC1)c1cc(-c2ccc4c(c2)c2ccccc2n4-c2ccccc2)ccc1n3-c1nc(-c2ccccc2)c2ccccc2n1
InChIInChI=1S/C48H32N4/c1-3-14-32(15-4-1)47-38-20-9-11-21-41(38)49-48(50-47)52-44-27-25-34(30-40(44)46-36-18-8-7-13-31(36)23-28-45(46)52)33-24-26-43-39(29-33)37-19-10-12-22-42(37)51(43)35-16-5-2-6-17-35/h1-7,9-17,19-30H,8,18H2
InChIKeyRRIIBVBUMLYUGL-UHFFFAOYSA-N
XLogP12.12
TPSA35.64 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms52
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500664.81
LogP ≤ 512.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3-(9-phenylcarbazol-3-yl)-9-[4-[4-(4-phenylphenyl)phenyl]quinazolin-2-yl]carbazole
CID 90050965
9-phenyl-3-(9-phenylcarbazol-3-yl)-6-[9-[4-[4-[2-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]quinazolin-4-yl]phenyl]phenyl]carbazol-3-yl]carbazole
CID 146176762
3-(9-phenylcarbazol-3-yl)-9-[4-(9-phenylcarbazol-3-yl)quinazolin-2-yl]carbazole
CID 118133212
7-(4-phenylphenyl)-10-[7-(4-phenylquinazolin-2-yl)benzo[c]carbazol-10-yl]benzo[c]carbazole;7-(4-phenylphenyl)-10-[9-(4-phenylquinazolin-2-yl)carbazol-3-yl]benzo[c]carbazole
CID 165103211
9-phenyl-2-[9-(4-phenylquinazolin-2-yl)-7,8-dihydrocarbazol-3-yl]carbazole
CID 163569923
3-[4-(9-phenylcarbazol-3-yl)phenyl]-9-[4-(3-phenylphenyl)quinazolin-2-yl]carbazole
CID 118067227
2-[9-[4-(4-carbazol-9-ylphenyl)quinazolin-2-yl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[4-(4-carbazol-9-ylphenyl)quinazolin-2-yl]carbazol-2-yl]-9-phenylcarbazole
CID 162263267
4-[2-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]quinazolin-4-yl]phenol
CID 136980186
7-[4-[4-[3-(9-phenylcarbazol-3-yl)phenyl]phenyl]quinazolin-2-yl]benzo[c]carbazole
CID 71109055
7-(4-naphthalen-2-ylphenyl)-10-[9-(4-phenylquinazolin-2-yl)carbazol-3-yl]benzo[c]carbazole
CID 164784298
12-[4-(9-phenylcarbazol-3-yl)quinazolin-2-yl]-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene
CID 71109102
9-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-12-phenylindolo[3,2-c]carbazole;3-(9-phenylcarbazol-3-yl)-9-(4-phenylquinazolin-2-yl)carbazole
CID 161306805

Frequently Asked Questions

What is the IUPAC name of 10-(9-phenylcarbazol-3-yl)-7-(4-phenylquinazolin-2-yl)-1,2-dihydrobenzo[c]carbazole?
The IUPAC name of 10-(9-phenylcarbazol-3-yl)-7-(4-phenylquinazolin-2-yl)-1,2-dihydrobenzo[c]carbazole (CID 165155024) is 10-(9-phenylcarbazol-3-yl)-7-(4-phenylquinazolin-2-yl)-1,2-dihydrobenzo[c]carbazole.
What is the SMILES notation for 10-(9-phenylcarbazol-3-yl)-7-(4-phenylquinazolin-2-yl)-1,2-dihydrobenzo[c]carbazole?
The canonical SMILES for 10-(9-phenylcarbazol-3-yl)-7-(4-phenylquinazolin-2-yl)-1,2-dihydrobenzo[c]carbazole is C1=Cc2ccc3c(c2CC1)c1cc(-c2ccc4c(c2)c2ccccc2n4-c2ccccc2)ccc1n3-c1nc(-c2ccccc2)c2ccccc2n1.
What is the InChIKey of 10-(9-phenylcarbazol-3-yl)-7-(4-phenylquinazolin-2-yl)-1,2-dihydrobenzo[c]carbazole?
The InChIKey is RRIIBVBUMLYUGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H32N4/c1-3-14-32(15-4-1)47-38-20-9-11-21-41(38)49-48(50-47)52-44-27-25-34(30-40(44)46-36-18-8-7-13-31(36)23-28-45(46)52)33-24-26-43-39(29-33)37-19-10-12-22-42(37)51(43)35-16-5-2-6-17-35/h1-7,9-17,19-30H,8,18H2.
What are the key properties of 10-(9-phenylcarbazol-3-yl)-7-(4-phenylquinazolin-2-yl)-1,2-dihydrobenzo[c]carbazole?
10-(9-phenylcarbazol-3-yl)-7-(4-phenylquinazolin-2-yl)-1,2-dihydrobenzo[c]carbazole has a molecular weight of 664.81 g/mol, XLogP of 12.12, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 10-(9-phenylcarbazol-3-yl)-7-(4-phenylquinazolin-2-yl)-1,2-dihydrobenzo[c]carbazole is sourced from PubChem (CID 165155024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).