3-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)-N-{2-[1-(propan-2-yl)-1H-benzimidazol-2-yl]ethyl}propanamide
Chemical Structure Depiction of
3-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)-N-{2-[1-(propan-2-yl)-1H-benzimidazol-2-yl]ethyl}propanamide
3-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)-N-{2-[1-(propan-2-yl)-1H-benzimidazol-2-yl]ethyl}propanamide
Compound characteristics
| Compound ID: | IB08-2143 |
| Compound Name: | 3-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)-N-{2-[1-(propan-2-yl)-1H-benzimidazol-2-yl]ethyl}propanamide |
| Molecular Weight: | 404.47 |
| Molecular Formula: | C22 H24 N6 O2 |
| Smiles: | CC(C)n1c2ccccc2nc1CCNC(CCN1C(c2ccccc2N=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.56 |
| logD: | 2.55 |
| logSw: | -3.8 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 114.54 |
| InChI Key: | IHZMMJWQBODPFL-UHFFFAOYSA-N |