N-[(5-bromo-2-methoxyphenyl)methyl]-3-(3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)propanamide
Chemical Structure Depiction of
N-[(5-bromo-2-methoxyphenyl)methyl]-3-(3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)propanamide
N-[(5-bromo-2-methoxyphenyl)methyl]-3-(3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)propanamide
Compound characteristics
| Compound ID: | K786-5082 |
| Compound Name: | N-[(5-bromo-2-methoxyphenyl)methyl]-3-(3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)propanamide |
| Molecular Weight: | 419.27 |
| Molecular Formula: | C19 H19 Br N2 O4 |
| Smiles: | COc1ccc(cc1CNC(CCN1C(COc2ccccc12)=O)=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 2.6318 |
| logD: | 2.6318 |
| logSw: | -3.0394 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.148 |
| InChI Key: | KPXYSWDVKDCUSX-UHFFFAOYSA-N |