N-{4-[2-(1H-benzimidazol-2-yl)ethyl]phenyl}-2-(3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)butanamide
Chemical Structure Depiction of
N-{4-[2-(1H-benzimidazol-2-yl)ethyl]phenyl}-2-(3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)butanamide
N-{4-[2-(1H-benzimidazol-2-yl)ethyl]phenyl}-2-(3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)butanamide
Compound characteristics
| Compound ID: | F255-0229 |
| Compound Name: | N-{4-[2-(1H-benzimidazol-2-yl)ethyl]phenyl}-2-(3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)butanamide |
| Molecular Weight: | 454.53 |
| Molecular Formula: | C27 H26 N4 O3 |
| Smiles: | [H]n1c2ccccc2nc1CCc1ccc(cc1)NC(C(CC)N1C(COc2ccccc12)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.429 |
| logD: | 4.4035 |
| logSw: | -4.3991 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.366 |
| InChI Key: | XDKRHKWRHUJXNA-QFIPXVFZSA-N |