2-({5-[(2,7-dimethyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)methyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(propan-2-yl)acetamide
Chemical Structure Depiction of
2-({5-[(2,7-dimethyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)methyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(propan-2-yl)acetamide
2-({5-[(2,7-dimethyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)methyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(propan-2-yl)acetamide
Compound characteristics
| Compound ID: | D483-1314 |
| Compound Name: | 2-({5-[(2,7-dimethyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)methyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(propan-2-yl)acetamide |
| Molecular Weight: | 400.5 |
| Molecular Formula: | C19 H24 N6 O2 S |
| Smiles: | CC(C)NC(CSc1nnc(CC2=C(C)N=C3C=CC(C)=CN3C2=O)n1C)=O |
| Stereo: | ACHIRAL |
| logP: | 0.6106 |
| logD: | 0.6106 |
| logSw: | -1.7036 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.161 |
| InChI Key: | YRISSTYWJMTYLH-UHFFFAOYSA-N |