5-[4-(1-phenylbenzimidazol-2-yl)naphthalen-1-yl]quinolin-8-ol

C32H21N3O — CID 136502698

IUPAC5-[4-(1-phenylbenzimidazol-2-yl)naphthalen-1-yl]quinolin-8-ol
SMILESOc1ccc(-c2ccc(-c3nc4ccccc4n3-c3ccccc3)c3ccccc23)c2cccnc12
InChIInChI=1S/C32H21N3O/c36-30-19-18-25(26-13-8-20-33-31(26)30)24-16-17-27(23-12-5-4-11-22(23)24)32-34-28-14-6-7-15-29(28)35(32)21-9-2-1-3-10-21/h1-20,36H
InChIKeyDFCUZPPJLPYLKO-UHFFFAOYSA-N
MW463.54 g/mol
LogP7.77
Rot. Bonds3

About 5-[4-(1-phenylbenzimidazol-2-yl)naphthalen-1-yl]quinolin-8-ol

5-[4-(1-phenylbenzimidazol-2-yl)naphthalen-1-yl]quinolin-8-ol (PubChem CID 136502698) has the molecular formula C32H21N3O and a molecular weight of 463.54 g/mol. Its IUPAC name is 5-[4-(1-phenylbenzimidazol-2-yl)naphthalen-1-yl]quinolin-8-ol.

Molecular Properties

Compound Name5-[4-(1-phenylbenzimidazol-2-yl)naphthalen-1-yl]quinolin-8-ol
PubChem CID136502698
Molecular FormulaC32H21N3O
Molecular Weight463.54 g/mol
Exact Mass463.17
IUPAC Name5-[4-(1-phenylbenzimidazol-2-yl)naphthalen-1-yl]quinolin-8-ol
SMILESOc1ccc(-c2ccc(-c3nc4ccccc4n3-c3ccccc3)c3ccccc23)c2cccnc12
InChIInChI=1S/C32H21N3O/c36-30-19-18-25(26-13-8-20-33-31(26)30)24-16-17-27(23-12-5-4-11-22(23)24)32-34-28-14-6-7-15-29(28)35(32)21-9-2-1-3-10-21/h1-20,36H
InChIKeyDFCUZPPJLPYLKO-UHFFFAOYSA-N
XLogP7.77
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500463.54
LogP ≤ 57.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

7-[4-(1-phenylbenzimidazol-2-yl)naphthalen-1-yl]quinolin-8-ol
CID 136502697
1-phenyl-2-[4-[4-(1-phenylbenzimidazol-2-yl)naphthalen-1-yl]naphthalen-1-yl]benzimidazole
CID 129257071
6-[5-(1-phenylbenzimidazol-2-yl)quinolin-8-yl]benzo[k]phenanthridine
CID 122665500
8-(1-phenylbenzimidazol-2-yl)quinoline
CID 23527786
5,8-bis[4-(2-naphthalen-1-ylbenzimidazol-1-yl)phenyl]quinoline
CID 138705133
7-[10-[4-(1-phenylbenzimidazol-2-yl)phenyl]anthracen-9-yl]quinolin-8-ol
CID 136502686
5,8-bis[4-[1-(3-phenylphenyl)benzimidazol-2-yl]phenyl]quinoline
CID 138705115
5,8-bis[4-(1-phenylbenzimidazol-2-yl)phenyl]quinoxaline
CID 138705119
7-[10-(8-hydroxyquinolin-7-yl)-3-[4-(1-phenylbenzimidazol-2-yl)phenyl]anthracen-9-yl]quinolin-8-ol
CID 136502638
1-phenyl-2-(1-phenylbenzimidazol-2-yl)benzimidazole
CID 44622931
6-[3-[3-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]benzo[h]quinoline
CID 146976715
5-naphthalen-1-ylquinolin-8-ol;zinc
CID 20606771

Frequently Asked Questions

What is the IUPAC name of 5-[4-(1-phenylbenzimidazol-2-yl)naphthalen-1-yl]quinolin-8-ol?
The IUPAC name of 5-[4-(1-phenylbenzimidazol-2-yl)naphthalen-1-yl]quinolin-8-ol (CID 136502698) is 5-[4-(1-phenylbenzimidazol-2-yl)naphthalen-1-yl]quinolin-8-ol.
What is the SMILES notation for 5-[4-(1-phenylbenzimidazol-2-yl)naphthalen-1-yl]quinolin-8-ol?
The canonical SMILES for 5-[4-(1-phenylbenzimidazol-2-yl)naphthalen-1-yl]quinolin-8-ol is Oc1ccc(-c2ccc(-c3nc4ccccc4n3-c3ccccc3)c3ccccc23)c2cccnc12.
What is the InChIKey of 5-[4-(1-phenylbenzimidazol-2-yl)naphthalen-1-yl]quinolin-8-ol?
The InChIKey is DFCUZPPJLPYLKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H21N3O/c36-30-19-18-25(26-13-8-20-33-31(26)30)24-16-17-27(23-12-5-4-11-22(23)24)32-34-28-14-6-7-15-29(28)35(32)21-9-2-1-3-10-21/h1-20,36H.
What are the key properties of 5-[4-(1-phenylbenzimidazol-2-yl)naphthalen-1-yl]quinolin-8-ol?
5-[4-(1-phenylbenzimidazol-2-yl)naphthalen-1-yl]quinolin-8-ol has a molecular weight of 463.54 g/mol, XLogP of 7.77, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[4-(1-phenylbenzimidazol-2-yl)naphthalen-1-yl]quinolin-8-ol is sourced from PubChem (CID 136502698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).