4-{6-[(4-chloro-3-methylphenoxy)acetyl]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-[(oxolan-2-yl)methyl]butanamide
Chemical Structure Depiction of
4-{6-[(4-chloro-3-methylphenoxy)acetyl]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-[(oxolan-2-yl)methyl]butanamide
4-{6-[(4-chloro-3-methylphenoxy)acetyl]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-[(oxolan-2-yl)methyl]butanamide
Compound characteristics
| Compound ID: | V023-3237 |
| Compound Name: | 4-{6-[(4-chloro-3-methylphenoxy)acetyl]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-[(oxolan-2-yl)methyl]butanamide |
| Molecular Weight: | 500.98 |
| Molecular Formula: | C26 H29 Cl N2 O6 |
| Smiles: | Cc1cc(ccc1[Cl])OCC(c1ccc2c(c1)N(CCCC(NCC1CCCO1)=O)C(CO2)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4101 |
| logD: | 2.4101 |
| logSw: | -3.2854 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.647 |
| InChI Key: | LFZILQQXYXUIGH-HXUWFJFHSA-N |