N-{3-[2-(1H-benzimidazol-2-yl)ethyl]phenyl}-2-(6-chloro-2-ethyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)acetamide
Chemical Structure Depiction of
N-{3-[2-(1H-benzimidazol-2-yl)ethyl]phenyl}-2-(6-chloro-2-ethyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)acetamide
N-{3-[2-(1H-benzimidazol-2-yl)ethyl]phenyl}-2-(6-chloro-2-ethyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)acetamide
Compound characteristics
| Compound ID: | F779-0821 |
| Compound Name: | N-{3-[2-(1H-benzimidazol-2-yl)ethyl]phenyl}-2-(6-chloro-2-ethyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)acetamide |
| Molecular Weight: | 488.97 |
| Molecular Formula: | C27 H25 Cl N4 O3 |
| Smiles: | [H]n1c2ccccc2nc1CCc1cccc(c1)NC(CN1C(C(CC)Oc2ccc(cc12)[Cl])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.5253 |
| logD: | 5.4998 |
| logSw: | -5.6868 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.426 |
| InChI Key: | ZZBBIGICEXVAJJ-HSZRJFAPSA-N |