(+/-)-3-[1-(5-Benzyl-3-methyl-4-oxo-4,5-dihydro-isoxazolo[5,4-d]pyrimidin-6-yl)-propylamino]-propionamide

HCID 22222259
Substructure searchFind similar structures

Basic information

Standard SMILES
CCC(NCCC(N)=O)c1nc2onc(C)c2c(=O)n1Cc1ccccc1
InChIKey
BHLKDAGWJWNEIN-UHFFFAOYSA-N
Molecular formula
C19H23N5O3
Average molar mass
369.4 g/mol

Names & identifiers

Preferred name
(+/-)-3-[1-(5-Benzyl-3-methyl-4-oxo-4,5-dihydro-isoxazolo[5,4-d]pyrimidin-6-yl)-propylamino]-propionamide
IUPAC
3-[1-(5-benzyl-3-methyl-4-oxo-[1,2]oxazolo[5,4-d]pyrimidin-6-yl)propylamino]propanamide

Names & synonyms

SCHEMBL5899066BHLKDAGWJWNEIN-UHFFFAOYSA-N(+/-)-3-[1-(5-benzyl-3-methyl-4-oxo-4,5-dihydro-isoxazolo[5,4-d]pyrimidin-6-yl)-propylamino]-propionamide

Database identifiers

PubChem CID
22222259

Properties

Computed structural properties

XLogP
0.9
Topological polar surface area
114 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
8
Heavy atoms
27

Related reactions

1 records
New reaction record

Linked notes

Loading…