N-(7-Chloro-4-oxo-1-phenyl-1,4-dihydro-quinolin-3-ylmethyl)-6-(2-hydroxy-ethyl-amino)-nicotinamide

HCID 71208705
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Basic information

Standard SMILES
O=C(NCc1cn(-c2ccccc2)c2cc(Cl)ccc2c1=O)c1ccc(NCCO)nc1
InChIKey
FIJXVKOKYPXWFF-UHFFFAOYSA-N
Molecular formula
C24H21ClN4O3
Average molar mass
448.9 g/mol
Monoisotopic mass
448.1302182

Names & identifiers

Preferred name
N-(7-Chloro-4-oxo-1-phenyl-1,4-dihydro-quinolin-3-ylmethyl)-6-(2-hydroxy-ethyl-amino)-nicotinamide
IUPAC
N-[(7-chloro-4-oxo-1-phenylquinolin-3-yl)methyl]-6-(2-hydroxyethylamino)pyridine-3-carboxamide

Names & synonyms

CHEMBL3679497SCHEMBL14575972FIJXVKOKYPXWFF-UHFFFAOYSA-NBDBM100517US8501732, I-77N-(7-Chloro-4-oxo-1-phenyl-1,4-dihydro-quinolin-3-ylmethyl)-6-(2-hydroxy-ethyl-amino)-nicotinamide

Database identifiers

PubChem CID
71208705
ChEMBL
CHEMBL3679497

Properties

Computed structural properties

XLogP
3.8
Topological polar surface area
94.6 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
6
Rotatable bonds
7
Heavy atoms
32

Related reactions

2 records
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Compound notes

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