2-[(3R)-2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-3-yl]-N-(5-ethyl-1H-1,2,4-triazol-3-yl)acetamide
Chemical Structure Depiction of
2-[(3R)-2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-3-yl]-N-(5-ethyl-1H-1,2,4-triazol-3-yl)acetamide
2-[(3R)-2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-3-yl]-N-(5-ethyl-1H-1,2,4-triazol-3-yl)acetamide
Compound characteristics
| Compound ID: | J100-0322 |
| Compound Name: | 2-[(3R)-2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-3-yl]-N-(5-ethyl-1H-1,2,4-triazol-3-yl)acetamide |
| Molecular Weight: | 328.33 |
| Molecular Formula: | C15 H16 N6 O3 |
| Smiles: | CCc1nc(NC(C[C@@H]2C(Nc3ccccc3C(N2)=O)=O)=O)n[nH]1 |
| Stereo: | ABSOLUTE |
| logP: | 0.8797 |
| logD: | 0.8178 |
| logSw: | -2.4309 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 110.281 |
| InChI Key: | RPQBHCBQLVMPRH-SNVBAGLBSA-N |