Details of the Drug

General Information of Drug (ID: DM4G6LJ)

Drug Name

N-phenethyl-2-phenylquinoline-4-carboxamide

Synonyms

N-phenethyl-2-phenylquinoline-4-carboxamide; 2-Phenyl-quinoline-4-carboxylic acid phenethyl-amide; 65628-69-5; BAS 00329480; ChemDiv3_013317; AC1MIR97; Oprea1_331981; Oprea1_089083; CBDivE_013546; CHEMBL1278237; CTK1I2246; DTXSID50389216; MolPort-001-924-745; HMS1510N07; ZINC3036412; AKOS000577213; MCULE-8602191420; NCGC00320157-01; EU-0063663; AB01317027-02; SR-01000583017; SR-01000583017-1; BRD-K88997350-001-01-1; 4-Quinolinecarboxamide, 2-phenyl-N-(2-phenylethyl)-

Indication

Disease Entry	ICD 11	Status	REF
Discovery agent	N.A.	Investigative	[1]
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Drug Type

Small molecular drug

Structure

3D MOL

2D MOL

#Ro5 Violations (Lipinski): 1

Molecular Weight (mw)

352.4

Logarithm of the Partition Coefficient (xlogp)

5.1

Rotatable Bond Count (rotbonds)

5

Hydrogen Bond Donor Count (hbonddonor)

1

Hydrogen Bond Acceptor Count (hbondacc)

2

Chemical Identifiers

Formula: C24H20N2O
IUPAC Name: 2-phenyl-N-(2-phenylethyl)quinoline-4-carboxamide
Canonical SMILES: C1=CC=C(C=C1)CCNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4
InChI: InChI=1S/C24H20N2O/c27-24(25-16-15-18-9-3-1-4-10-18)21-17-23(19-11-5-2-6-12-19)26-22-14-8-7-13-20(21)22/h1-14,17H,15-16H2,(H,25,27)
InChIKey: LVSGZPVWALHPET-UHFFFAOYSA-N