N-[(1S)-1-(1H-benzimidazol-2-yl)-2-methylpropyl]-4-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)butanamide
Chemical Structure Depiction of
N-[(1S)-1-(1H-benzimidazol-2-yl)-2-methylpropyl]-4-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)butanamide
N-[(1S)-1-(1H-benzimidazol-2-yl)-2-methylpropyl]-4-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)butanamide
Compound characteristics
| Compound ID: | Y042-6523 |
| Compound Name: | N-[(1S)-1-(1H-benzimidazol-2-yl)-2-methylpropyl]-4-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)butanamide |
| Molecular Weight: | 404.47 |
| Molecular Formula: | C22 H24 N6 O2 |
| Smiles: | CC(C)[C@@H](c1nc2ccccc2[nH]1)NC(CCCN1C(c2ccccc2N=N1)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.6117 |
| logD: | 2.6107 |
| logSw: | -3.3191 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.026 |
| InChI Key: | LIMAAOFNAMMPIJ-FQEVSTJZSA-N |