3-(7-naphthalen-1-ylbenzo[c]carbazol-2-yl)-7-(4-phenylphenyl)benzo[c]carbazole

C54H34N2 — CID 130351412

IUPAC3-(7-naphthalen-1-ylbenzo[c]carbazol-2-yl)-7-(4-phenylphenyl)benzo[c]carbazole
SMILESc1ccc(-c2ccc(-n3c4ccccc4c4c5ccc(-c6ccc7ccc8c(c7c6)c6ccccc6n8-c6cccc7ccccc67)cc5ccc43)cc2)cc1
InChIInChI=1S/C54H34N2/c1-2-11-35(12-3-1)36-23-28-42(29-24-36)55-49-18-8-6-16-45(49)53-44-30-25-39(33-41(44)27-32-51(53)55)40-22-21-38-26-31-52-54(47(38)34-40)46-17-7-9-19-50(46)56(52)48-20-10-14-37-13-4-5-15-43(37)48/h1-34H
InChIKeyYDYHDHNIWOPGPG-UHFFFAOYSA-N
MW710.88 g/mol
LogP14.67
Rot. Bonds4

About 3-(7-naphthalen-1-ylbenzo[c]carbazol-2-yl)-7-(4-phenylphenyl)benzo[c]carbazole

3-(7-naphthalen-1-ylbenzo[c]carbazol-2-yl)-7-(4-phenylphenyl)benzo[c]carbazole (PubChem CID 130351412) has the molecular formula C54H34N2 and a molecular weight of 710.88 g/mol. Its IUPAC name is 3-(7-naphthalen-1-ylbenzo[c]carbazol-2-yl)-7-(4-phenylphenyl)benzo[c]carbazole.

Molecular Properties

Compound Name3-(7-naphthalen-1-ylbenzo[c]carbazol-2-yl)-7-(4-phenylphenyl)benzo[c]carbazole
PubChem CID130351412
Molecular FormulaC54H34N2
Molecular Weight710.88 g/mol
Exact Mass710.27
IUPAC Name3-(7-naphthalen-1-ylbenzo[c]carbazol-2-yl)-7-(4-phenylphenyl)benzo[c]carbazole
SMILESc1ccc(-c2ccc(-n3c4ccccc4c4c5ccc(-c6ccc7ccc8c(c7c6)c6ccccc6n8-c6cccc7ccccc67)cc5ccc43)cc2)cc1
InChIInChI=1S/C54H34N2/c1-2-11-35(12-3-1)36-23-28-42(29-24-36)55-49-18-8-6-16-45(49)53-44-30-25-39(33-41(44)27-32-51(53)55)40-22-21-38-26-31-52-54(47(38)34-40)46-17-7-9-19-50(46)56(52)48-20-10-14-37-13-4-5-15-43(37)48/h1-34H
InChIKeyYDYHDHNIWOPGPG-UHFFFAOYSA-N
XLogP14.67
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms56
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500710.88
LogP ≤ 514.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 3-(7-naphthalen-1-ylbenzo[c]carbazol-2-yl)-7-(4-phenylphenyl)benzo[c]carbazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(7-naphthalen-1-ylbenzo[c]carbazol-3-yl)-7-(4-phenylphenyl)benzo[c]carbazole;7-phenyl-2-(7-phenylbenzo[c]carbazol-10-yl)benzo[c]carbazole
CID 160886256
2-(7-naphthalen-1-ylbenzo[c]carbazol-2-yl)-7-phenylbenzo[c]carbazole
CID 131979777
7-naphthalen-1-yl-2-(6-phenylnaphthalen-2-yl)benzo[c]carbazole
CID 130350960
7-naphthalen-1-yl-2-phenylbenzo[c]carbazole
CID 130351033
9-naphthalen-1-yl-14-(6-phenylnaphthalen-1-yl)-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 142551551
7-phenyl-3-(7-phenylbenzo[c]carbazol-10-yl)benzo[c]carbazole
CID 130351055
3-(9-naphthalen-1-ylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole;9-(4-phenylphenyl)-3-[9-(4-phenylphenyl)carbazol-3-yl]carbazole
CID 159733846
2-(9-naphthalen-1-ylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole
CID 142356851
9,14-dinaphthalen-1-yl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;9,14-dinaphthalen-2-yl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;5-phenyl-9,14-bis(4-phenylphenyl)-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene;5-phenyl-9-(3-phenylphenyl)-14-(4-phenylphenyl)-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene
CID 162237950
7-naphthalen-1-yl-3-(7-naphthalen-2-ylnaphthalen-2-yl)benzo[c]carbazole
CID 130351193
5-naphthalen-1-yl-12-(6-phenylnaphthalen-1-yl)indolo[3,2-c]carbazole
CID 142482126
5-naphthalen-1-yl-12-[4-(9-phenylcarbazol-3-yl)phenyl]indolo[3,2-c]carbazole
CID 134168763

Frequently Asked Questions

What is the IUPAC name of 3-(7-naphthalen-1-ylbenzo[c]carbazol-2-yl)-7-(4-phenylphenyl)benzo[c]carbazole?
The IUPAC name of 3-(7-naphthalen-1-ylbenzo[c]carbazol-2-yl)-7-(4-phenylphenyl)benzo[c]carbazole (CID 130351412) is 3-(7-naphthalen-1-ylbenzo[c]carbazol-2-yl)-7-(4-phenylphenyl)benzo[c]carbazole.
What is the SMILES notation for 3-(7-naphthalen-1-ylbenzo[c]carbazol-2-yl)-7-(4-phenylphenyl)benzo[c]carbazole?
The canonical SMILES for 3-(7-naphthalen-1-ylbenzo[c]carbazol-2-yl)-7-(4-phenylphenyl)benzo[c]carbazole is c1ccc(-c2ccc(-n3c4ccccc4c4c5ccc(-c6ccc7ccc8c(c7c6)c6ccccc6n8-c6cccc7ccccc67)cc5ccc43)cc2)cc1.
What is the InChIKey of 3-(7-naphthalen-1-ylbenzo[c]carbazol-2-yl)-7-(4-phenylphenyl)benzo[c]carbazole?
The InChIKey is YDYHDHNIWOPGPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C54H34N2/c1-2-11-35(12-3-1)36-23-28-42(29-24-36)55-49-18-8-6-16-45(49)53-44-30-25-39(33-41(44)27-32-51(53)55)40-22-21-38-26-31-52-54(47(38)34-40)46-17-7-9-19-50(46)56(52)48-20-10-14-37-13-4-5-15-43(37)48/h1-34H.
What are the key properties of 3-(7-naphthalen-1-ylbenzo[c]carbazol-2-yl)-7-(4-phenylphenyl)benzo[c]carbazole?
3-(7-naphthalen-1-ylbenzo[c]carbazol-2-yl)-7-(4-phenylphenyl)benzo[c]carbazole has a molecular weight of 710.88 g/mol, XLogP of 14.67, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(7-naphthalen-1-ylbenzo[c]carbazol-2-yl)-7-(4-phenylphenyl)benzo[c]carbazole is sourced from PubChem (CID 130351412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).