N-{2-[2-(1H-benzimidazol-2-yl)ethyl]phenyl}-2-(6-chloro-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)acetamide
Chemical Structure Depiction of
N-{2-[2-(1H-benzimidazol-2-yl)ethyl]phenyl}-2-(6-chloro-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)acetamide
N-{2-[2-(1H-benzimidazol-2-yl)ethyl]phenyl}-2-(6-chloro-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)acetamide
Compound characteristics
| Compound ID: | F780-6523 |
| Compound Name: | N-{2-[2-(1H-benzimidazol-2-yl)ethyl]phenyl}-2-(6-chloro-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)acetamide |
| Molecular Weight: | 460.92 |
| Molecular Formula: | C25 H21 Cl N4 O3 |
| Smiles: | C(Cc1nc2ccccc2[nH]1)c1ccccc1NC(CN1C(COc2ccc(cc12)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3923 |
| logD: | 4.3323 |
| logSw: | -4.5958 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.53 |
| InChI Key: | JTHOWYJYTTYZGN-UHFFFAOYSA-N |