3-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-(5-ethyl-4-phenyl-1,3-thiazol-2-yl)propanamide
Chemical Structure Depiction of
3-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-(5-ethyl-4-phenyl-1,3-thiazol-2-yl)propanamide
3-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-(5-ethyl-4-phenyl-1,3-thiazol-2-yl)propanamide
Compound characteristics
| Compound ID: | Y031-7108 |
| Compound Name: | 3-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-(5-ethyl-4-phenyl-1,3-thiazol-2-yl)propanamide |
| Molecular Weight: | 438.51 |
| Molecular Formula: | C21 H22 N6 O3 S |
| Smiles: | CCc1c(c2ccccc2)nc(NC(CCn2cnc3c2C(N(C)C(N3C)=O)=O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 2.8334 |
| logD: | 2.8328 |
| logSw: | -3.3282 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.633 |
| InChI Key: | MRPJFXKMSJJLEU-UHFFFAOYSA-N |