N-(4-bromo-2-fluorophenyl)-3-(3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)propanamide
Chemical Structure Depiction of
N-(4-bromo-2-fluorophenyl)-3-(3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)propanamide
N-(4-bromo-2-fluorophenyl)-3-(3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)propanamide
Compound characteristics
| Compound ID: | E667-0484 |
| Compound Name: | N-(4-bromo-2-fluorophenyl)-3-(3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)propanamide |
| Molecular Weight: | 457.27 |
| Molecular Formula: | C17 H14 Br F N2 O5 S |
| Smiles: | C(CS(c1ccc2c(c1)NC(CO2)=O)(=O)=O)C(Nc1ccc(cc1F)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 1.7203 |
| logD: | 1.639 |
| logSw: | -2.5332 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.725 |
| InChI Key: | RVCQLLGBYPPZGB-UHFFFAOYSA-N |