4-{6-[(2,6-dimethylphenoxy)acetyl]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-[(4-fluorophenyl)methyl]butanamide
Chemical Structure Depiction of
4-{6-[(2,6-dimethylphenoxy)acetyl]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-[(4-fluorophenyl)methyl]butanamide
4-{6-[(2,6-dimethylphenoxy)acetyl]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-[(4-fluorophenyl)methyl]butanamide
Compound characteristics
| Compound ID: | V014-2996 |
| Compound Name: | 4-{6-[(2,6-dimethylphenoxy)acetyl]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-[(4-fluorophenyl)methyl]butanamide |
| Molecular Weight: | 504.56 |
| Molecular Formula: | C29 H29 F N2 O5 |
| Smiles: | Cc1cccc(C)c1OCC(c1ccc2c(c1)N(CCCC(NCc1ccc(cc1)F)=O)C(CO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6637 |
| logD: | 3.6637 |
| logSw: | -4.0468 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.166 |
| InChI Key: | MONAOLPRTKSZQB-UHFFFAOYSA-N |