3-[(3R)-2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-3-yl]-N-[5-(2-methylpropyl)-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-[5-(2-methylpropyl)-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-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]propanamide
Compound characteristics
| Compound ID: | J101-0283 |
| Compound Name: | 3-[(3R)-2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-3-yl]-N-[5-(2-methylpropyl)-1H-1,2,4-triazol-3-yl]propanamide |
| Molecular Weight: | 370.41 |
| Molecular Formula: | C18 H22 N6 O3 |
| Smiles: | CC(C)Cc1nc(NC(CC[C@@H]2C(Nc3ccccc3C(N2)=O)=O)=O)n[nH]1 |
| Stereo: | ABSOLUTE |
| logP: | 2.2936 |
| logD: | 2.2643 |
| logSw: | -3.0679 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 110.281 |
| InChI Key: | WTZWJWXQHSZCSS-CYBMUJFWSA-N |