5-phenyl-11-(1-phenylbenzimidazol-2-yl)indolo[3,2-c]quinolin-6-one

C34H22N4O — CID 155152444

IUPAC5-phenyl-11-(1-phenylbenzimidazol-2-yl)indolo[3,2-c]quinolin-6-one
SMILESO=c1c2c3ccccc3n(-c3nc4ccccc4n3-c3ccccc3)c2c2ccccc2n1-c1ccccc1
InChIInChI=1S/C34H22N4O/c39-33-31-25-17-7-10-20-28(25)38(32(31)26-18-8-11-21-29(26)36(33)23-13-3-1-4-14-23)34-35-27-19-9-12-22-30(27)37(34)24-15-5-2-6-16-24/h1-22H
InChIKeyDCNATNOUWSXYSQ-UHFFFAOYSA-N
MW502.58 g/mol
LogP7.43
Rot. Bonds3

About 5-phenyl-11-(1-phenylbenzimidazol-2-yl)indolo[3,2-c]quinolin-6-one

5-phenyl-11-(1-phenylbenzimidazol-2-yl)indolo[3,2-c]quinolin-6-one (PubChem CID 155152444) has the molecular formula C34H22N4O and a molecular weight of 502.58 g/mol. Its IUPAC name is 5-phenyl-11-(1-phenylbenzimidazol-2-yl)indolo[3,2-c]quinolin-6-one.

Molecular Properties

Compound Name5-phenyl-11-(1-phenylbenzimidazol-2-yl)indolo[3,2-c]quinolin-6-one
PubChem CID155152444
Molecular FormulaC34H22N4O
Molecular Weight502.58 g/mol
Exact Mass502.18
IUPAC Name5-phenyl-11-(1-phenylbenzimidazol-2-yl)indolo[3,2-c]quinolin-6-one
SMILESO=c1c2c3ccccc3n(-c3nc4ccccc4n3-c3ccccc3)c2c2ccccc2n1-c1ccccc1
InChIInChI=1S/C34H22N4O/c39-33-31-25-17-7-10-20-28(25)38(32(31)26-18-8-11-21-29(26)36(33)23-13-3-1-4-14-23)34-35-27-19-9-12-22-30(27)37(34)24-15-5-2-6-16-24/h1-22H
InChIKeyDCNATNOUWSXYSQ-UHFFFAOYSA-N
XLogP7.43
TPSA44.75 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms39
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500502.58
LogP ≤ 57.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-phenyl-11-(1-phenylbenzimidazol-2-yl)indolo[3,2-c]quinolin-6-one?
The IUPAC name of 5-phenyl-11-(1-phenylbenzimidazol-2-yl)indolo[3,2-c]quinolin-6-one (CID 155152444) is 5-phenyl-11-(1-phenylbenzimidazol-2-yl)indolo[3,2-c]quinolin-6-one.
What is the SMILES notation for 5-phenyl-11-(1-phenylbenzimidazol-2-yl)indolo[3,2-c]quinolin-6-one?
The canonical SMILES for 5-phenyl-11-(1-phenylbenzimidazol-2-yl)indolo[3,2-c]quinolin-6-one is O=c1c2c3ccccc3n(-c3nc4ccccc4n3-c3ccccc3)c2c2ccccc2n1-c1ccccc1.
What is the InChIKey of 5-phenyl-11-(1-phenylbenzimidazol-2-yl)indolo[3,2-c]quinolin-6-one?
The InChIKey is DCNATNOUWSXYSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H22N4O/c39-33-31-25-17-7-10-20-28(25)38(32(31)26-18-8-11-21-29(26)36(33)23-13-3-1-4-14-23)34-35-27-19-9-12-22-30(27)37(34)24-15-5-2-6-16-24/h1-22H.
What are the key properties of 5-phenyl-11-(1-phenylbenzimidazol-2-yl)indolo[3,2-c]quinolin-6-one?
5-phenyl-11-(1-phenylbenzimidazol-2-yl)indolo[3,2-c]quinolin-6-one has a molecular weight of 502.58 g/mol, XLogP of 7.43, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-phenyl-11-(1-phenylbenzimidazol-2-yl)indolo[3,2-c]quinolin-6-one is sourced from PubChem (CID 155152444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).