6-chloro-3-(6-chloroindol-1-yl)-1-methyl-4-phenylquinolin-2-one

C24H16Cl2N2O — CID 134306095

IUPAC6-chloro-3-(6-chloroindol-1-yl)-1-methyl-4-phenylquinolin-2-one
SMILESCn1c(=O)c(-n2ccc3ccc(Cl)cc32)c(-c2ccccc2)c2cc(Cl)ccc21
InChIInChI=1S/C24H16Cl2N2O/c1-27-20-10-9-17(25)13-19(20)22(16-5-3-2-4-6-16)23(24(27)29)28-12-11-15-7-8-18(26)14-21(15)28/h2-14H,1H3
InChIKeyAXXSVTRTDSKCGT-UHFFFAOYSA-N
MW419.31 g/mol
LogP6.46
Rot. Bonds2

About 6-chloro-3-(6-chloroindol-1-yl)-1-methyl-4-phenylquinolin-2-one

6-chloro-3-(6-chloroindol-1-yl)-1-methyl-4-phenylquinolin-2-one (PubChem CID 134306095) has the molecular formula C24H16Cl2N2O and a molecular weight of 419.31 g/mol. Its IUPAC name is 6-chloro-3-(6-chloroindol-1-yl)-1-methyl-4-phenylquinolin-2-one.

Molecular Properties

Compound Name6-chloro-3-(6-chloroindol-1-yl)-1-methyl-4-phenylquinolin-2-one
PubChem CID134306095
Molecular FormulaC24H16Cl2N2O
Molecular Weight419.31 g/mol
Exact Mass418.06
IUPAC Name6-chloro-3-(6-chloroindol-1-yl)-1-methyl-4-phenylquinolin-2-one
SMILESCn1c(=O)c(-n2ccc3ccc(Cl)cc32)c(-c2ccccc2)c2cc(Cl)ccc21
InChIInChI=1S/C24H16Cl2N2O/c1-27-20-10-9-17(25)13-19(20)22(16-5-3-2-4-6-16)23(24(27)29)28-12-11-15-7-8-18(26)14-21(15)28/h2-14H,1H3
InChIKeyAXXSVTRTDSKCGT-UHFFFAOYSA-N
XLogP6.46
TPSA26.93 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500419.31
LogP ≤ 56.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-(5-fluoroindol-1-yl)-1-methyl-4-phenylquinolin-2-one
CID 134306089
N-(6-chloro-1-methyl-2-oxo-4-phenylquinolin-3-yl)acetamide
CID 11727151
6-chloro-4-(4-chlorophenyl)-3-iodo-1-methylquinolin-2-one
CID 132992766
(5-chloro-1-methyl-3-phenylindol-2-yl) hydrogen carbonate
CID 67802401
6-chloro-3-(2-hydrazinyl-1,3-thiazol-4-yl)-1-methyl-4-phenylquinolin-2-one
CID 53348929
7-chloro-1-methyl-3-phenylquinoxalin-2-one
CID 163364599
4-(3-chlorophenyl)-1,3-dimethylquinolin-2-one
CID 22058094
6-chloro-3-[3-(furan-2-yl)prop-2-enoyl]-1-methyl-4-phenylquinolin-2-one
CID 3158329
6-chloro-1-(2-chlorophenyl)indole
CID 22049239
ethyl N-(5-chloro-1-methyl-3-phenylindol-2-yl)carbamate
CID 21387993
3-bromo-1-methyl-4-phenylquinolin-2-one
CID 50999162
6-chloro-2-methyl-3-phenylisoquinolin-1-one
CID 12931129

Frequently Asked Questions

What is the IUPAC name of 6-chloro-3-(6-chloroindol-1-yl)-1-methyl-4-phenylquinolin-2-one?
The IUPAC name of 6-chloro-3-(6-chloroindol-1-yl)-1-methyl-4-phenylquinolin-2-one (CID 134306095) is 6-chloro-3-(6-chloroindol-1-yl)-1-methyl-4-phenylquinolin-2-one.
What is the SMILES notation for 6-chloro-3-(6-chloroindol-1-yl)-1-methyl-4-phenylquinolin-2-one?
The canonical SMILES for 6-chloro-3-(6-chloroindol-1-yl)-1-methyl-4-phenylquinolin-2-one is Cn1c(=O)c(-n2ccc3ccc(Cl)cc32)c(-c2ccccc2)c2cc(Cl)ccc21.
What is the InChIKey of 6-chloro-3-(6-chloroindol-1-yl)-1-methyl-4-phenylquinolin-2-one?
The InChIKey is AXXSVTRTDSKCGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H16Cl2N2O/c1-27-20-10-9-17(25)13-19(20)22(16-5-3-2-4-6-16)23(24(27)29)28-12-11-15-7-8-18(26)14-21(15)28/h2-14H,1H3.
What are the key properties of 6-chloro-3-(6-chloroindol-1-yl)-1-methyl-4-phenylquinolin-2-one?
6-chloro-3-(6-chloroindol-1-yl)-1-methyl-4-phenylquinolin-2-one has a molecular weight of 419.31 g/mol, XLogP of 6.46, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-3-(6-chloroindol-1-yl)-1-methyl-4-phenylquinolin-2-one is sourced from PubChem (CID 134306095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).