N-(5-chloro-2-methylphenyl)-3-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)propanamide
Chemical Structure Depiction of
N-(5-chloro-2-methylphenyl)-3-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)propanamide
N-(5-chloro-2-methylphenyl)-3-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)propanamide
Compound characteristics
Compound ID: | Y031-7098 |
Compound Name: | N-(5-chloro-2-methylphenyl)-3-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)propanamide |
Molecular Weight: | 375.81 |
Molecular Formula: | C17 H18 Cl N5 O3 |
Smiles: | Cc1ccc(cc1NC(CCn1cnc2c1C(N(C)C(N2C)=O)=O)=O)[Cl] |
Stereo: | ACHIRAL |
logP: | 1.4724 |
logD: | 1.4717 |
logSw: | -2.7185 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 65.39 |
InChI Key: | SPRXQSIHWGEECQ-UHFFFAOYSA-N |