4-(6-chloro-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-[(2-methylphenyl)methyl]-4-oxobutanamide
Chemical Structure Depiction of
4-(6-chloro-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-[(2-methylphenyl)methyl]-4-oxobutanamide
4-(6-chloro-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-[(2-methylphenyl)methyl]-4-oxobutanamide
Compound characteristics
| Compound ID: | E015-0298 |
| Compound Name: | 4-(6-chloro-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-[(2-methylphenyl)methyl]-4-oxobutanamide |
| Molecular Weight: | 372.85 |
| Molecular Formula: | C20 H21 Cl N2 O3 |
| Smiles: | Cc1ccccc1CNC(CCC(N1CCOc2ccc(cc12)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5648 |
| logD: | 3.5648 |
| logSw: | -3.7922 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.447 |
| InChI Key: | NHTCXWAYCMIZOG-UHFFFAOYSA-N |