N-[(1S)-1-(1H-benzimidazol-2-yl)-2-methylpropyl]-3-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)propanamide
Chemical Structure Depiction of
N-[(1S)-1-(1H-benzimidazol-2-yl)-2-methylpropyl]-3-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)propanamide
N-[(1S)-1-(1H-benzimidazol-2-yl)-2-methylpropyl]-3-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)propanamide
Compound characteristics
| Compound ID: | Y042-6521 |
| Compound Name: | N-[(1S)-1-(1H-benzimidazol-2-yl)-2-methylpropyl]-3-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)propanamide |
| Molecular Weight: | 390.44 |
| Molecular Formula: | C21 H22 N6 O2 |
| Smiles: | CC(C)[C@@H](c1nc2ccccc2[nH]1)NC(CCN1C(c2ccccc2N=N1)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.8526 |
| logD: | 2.8515 |
| logSw: | -3.6346 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.026 |
| InChI Key: | AVRNDCUDVMAIIL-IBGZPJMESA-N |