1-phenyl-2-[3-(1-phenylnaphthalen-2-yl)naphthalen-2-yl]benzimidazole

C39H26N2 — CID 142488113

IUPAC1-phenyl-2-[3-(1-phenylnaphthalen-2-yl)naphthalen-2-yl]benzimidazole
SMILESc1ccc(-c2c(-c3cc4ccccc4cc3-c3nc4ccccc4n3-c3ccccc3)ccc3ccccc23)cc1
InChIInChI=1S/C39H26N2/c1-3-14-28(15-4-1)38-32-20-10-9-13-27(32)23-24-33(38)34-25-29-16-7-8-17-30(29)26-35(34)39-40-36-21-11-12-22-37(36)41(39)31-18-5-2-6-19-31/h1-26H
InChIKeyFLMQSGFGCPEKTA-UHFFFAOYSA-N
MW522.65 g/mol
LogP10.33
Rot. Bonds4

About 1-phenyl-2-[3-(1-phenylnaphthalen-2-yl)naphthalen-2-yl]benzimidazole

1-phenyl-2-[3-(1-phenylnaphthalen-2-yl)naphthalen-2-yl]benzimidazole (PubChem CID 142488113) has the molecular formula C39H26N2 and a molecular weight of 522.65 g/mol. Its IUPAC name is 1-phenyl-2-[3-(1-phenylnaphthalen-2-yl)naphthalen-2-yl]benzimidazole.

Molecular Properties

Compound Name1-phenyl-2-[3-(1-phenylnaphthalen-2-yl)naphthalen-2-yl]benzimidazole
PubChem CID142488113
Molecular FormulaC39H26N2
Molecular Weight522.65 g/mol
Exact Mass522.21
IUPAC Name1-phenyl-2-[3-(1-phenylnaphthalen-2-yl)naphthalen-2-yl]benzimidazole
SMILESc1ccc(-c2c(-c3cc4ccccc4cc3-c3nc4ccccc4n3-c3ccccc3)ccc3ccccc23)cc1
InChIInChI=1S/C39H26N2/c1-3-14-28(15-4-1)38-32-20-10-9-13-27(32)23-24-33(38)34-25-29-16-7-8-17-30(29)26-35(34)39-40-36-21-11-12-22-37(36)41(39)31-18-5-2-6-19-31/h1-26H
InChIKeyFLMQSGFGCPEKTA-UHFFFAOYSA-N
XLogP10.33
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms41
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500522.65
LogP ≤ 510.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]-1-phenylbenzimidazole
CID 129099562
N,N-diphenyl-3-[2-[4-(1-phenylbenzimidazol-2-yl)phenyl]naphthalen-1-yl]aniline
CID 174262436
2-(6-benzo[c]phenanthren-5-ylnaphthalen-2-yl)-1-phenylbenzimidazole
CID 88544794
1-phenyl-2-[4-(12-phenyltetracen-5-yl)phenyl]benzimidazole
CID 168827474
1-phenyl-2-[4-[4-(1-phenylbenzimidazol-2-yl)naphthalen-1-yl]naphthalen-1-yl]benzimidazole
CID 129257071
2-[3-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]phenyl]-1-phenylbenzimidazole
CID 166509976
2-[4-[10-[6-[10-(4-methylphenyl)anthracen-9-yl]naphthalen-2-yl]anthracen-9-yl]phenyl]-1-phenylbenzimidazole
CID 58894895
2-[4-(10-naphthalen-1-yl-9-naphthalen-2-ylanthracen-2-yl)naphthalen-1-yl]-1-phenylbenzimidazole
CID 118604213
2-[2,5-bis(1-phenylbenzimidazol-2-yl)phenyl]-1-phenylbenzimidazole
CID 141061579
2-benzo[c]phenanthren-2-yl-1-phenylbenzimidazole
CID 58526346
2-phenyl-1-[4-(11-phenyltetracen-5-yl)phenyl]benzimidazole
CID 168827456
1-phenyl-2-(2-phenylphenyl)benzimidazole
CID 139044287

Frequently Asked Questions

What is the IUPAC name of 1-phenyl-2-[3-(1-phenylnaphthalen-2-yl)naphthalen-2-yl]benzimidazole?
The IUPAC name of 1-phenyl-2-[3-(1-phenylnaphthalen-2-yl)naphthalen-2-yl]benzimidazole (CID 142488113) is 1-phenyl-2-[3-(1-phenylnaphthalen-2-yl)naphthalen-2-yl]benzimidazole.
What is the SMILES notation for 1-phenyl-2-[3-(1-phenylnaphthalen-2-yl)naphthalen-2-yl]benzimidazole?
The canonical SMILES for 1-phenyl-2-[3-(1-phenylnaphthalen-2-yl)naphthalen-2-yl]benzimidazole is c1ccc(-c2c(-c3cc4ccccc4cc3-c3nc4ccccc4n3-c3ccccc3)ccc3ccccc23)cc1.
What is the InChIKey of 1-phenyl-2-[3-(1-phenylnaphthalen-2-yl)naphthalen-2-yl]benzimidazole?
The InChIKey is FLMQSGFGCPEKTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C39H26N2/c1-3-14-28(15-4-1)38-32-20-10-9-13-27(32)23-24-33(38)34-25-29-16-7-8-17-30(29)26-35(34)39-40-36-21-11-12-22-37(36)41(39)31-18-5-2-6-19-31/h1-26H.
What are the key properties of 1-phenyl-2-[3-(1-phenylnaphthalen-2-yl)naphthalen-2-yl]benzimidazole?
1-phenyl-2-[3-(1-phenylnaphthalen-2-yl)naphthalen-2-yl]benzimidazole has a molecular weight of 522.65 g/mol, XLogP of 10.33, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-2-[3-(1-phenylnaphthalen-2-yl)naphthalen-2-yl]benzimidazole is sourced from PubChem (CID 142488113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).