3-[(3R)-2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-3-yl]-N-(1H-1,2,4-triazol-3-yl)propanamide
Chemical Structure Depiction of
3-[(3R)-2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-3-yl]-N-(1H-1,2,4-triazol-3-yl)propanamide
3-[(3R)-2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-3-yl]-N-(1H-1,2,4-triazol-3-yl)propanamide
Compound characteristics
| Compound ID: | J101-0278 |
| Compound Name: | 3-[(3R)-2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-3-yl]-N-(1H-1,2,4-triazol-3-yl)propanamide |
| Molecular Weight: | 314.3 |
| Molecular Formula: | C14 H14 N6 O3 |
| Smiles: | C(C[C@@H]1C(Nc2ccccc2C(N1)=O)=O)C(Nc1nc[nH]n1)=O |
| Stereo: | ABSOLUTE |
| logP: | 0.0316 |
| logD: | 0.0211 |
| logSw: | -2.2853 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 110.937 |
| InChI Key: | NSFDJCIKKNFVGG-JTQLQIEISA-N |