N-{4-[2-(5-methyl-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-(5-methyl-1H-benzimidazol-2-yl)ethyl]phenyl}-2-(3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)butanamide
N-{4-[2-(5-methyl-1H-benzimidazol-2-yl)ethyl]phenyl}-2-(3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)butanamide
Compound characteristics
| Compound ID: | F255-0677 |
| Compound Name: | N-{4-[2-(5-methyl-1H-benzimidazol-2-yl)ethyl]phenyl}-2-(3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)butanamide |
| Molecular Weight: | 468.56 |
| Molecular Formula: | C28 H28 N4 O3 |
| Smiles: | CCC(C(Nc1ccc(CCc2nc3cc(C)ccc3[nH]2)cc1)=O)N1C(COc2ccccc12)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8887 |
| logD: | 4.8731 |
| logSw: | -4.5964 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.366 |
| InChI Key: | VQPILRIZDAFZEX-QHCPKHFHSA-N |