N-(3-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-(3-chloro-2-methylphenyl)-3-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)propanamide
N-(3-chloro-2-methylphenyl)-3-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)propanamide
Compound characteristics
| Compound ID: | Y031-7085 |
| Compound Name: | N-(3-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: | Cc1c(cccc1[Cl])NC(CCn1cnc2c1C(N(C)C(N2C)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8226 |
| logD: | 1.8219 |
| logSw: | -2.5255 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.39 |
| InChI Key: | SIRRQPJSMWWFPD-UHFFFAOYSA-N |