N-{3-[2-(1-methyl-1H-benzimidazol-2-yl)ethyl]phenyl}-2-(2-methyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)acetamide
Chemical Structure Depiction of
N-{3-[2-(1-methyl-1H-benzimidazol-2-yl)ethyl]phenyl}-2-(2-methyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)acetamide
N-{3-[2-(1-methyl-1H-benzimidazol-2-yl)ethyl]phenyl}-2-(2-methyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)acetamide
Compound characteristics
| Compound ID: | F779-1193 |
| Compound Name: | N-{3-[2-(1-methyl-1H-benzimidazol-2-yl)ethyl]phenyl}-2-(2-methyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)acetamide |
| Molecular Weight: | 454.53 |
| Molecular Formula: | C27 H26 N4 O3 |
| Smiles: | CC1C(N(CC(Nc2cccc(CCc3nc4ccccc4n3C)c2)=O)c2ccccc2O1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2089 |
| logD: | 4.0842 |
| logSw: | -4.3311 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.936 |
| InChI Key: | CEDHJXLLNHBNIH-SFHVURJKSA-N |