N-(4-chloro-2-fluorophenyl)-3-(3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)propanamide
Chemical Structure Depiction of
N-(4-chloro-2-fluorophenyl)-3-(3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)propanamide
N-(4-chloro-2-fluorophenyl)-3-(3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)propanamide
Compound characteristics
| Compound ID: | E511-0413 |
| Compound Name: | N-(4-chloro-2-fluorophenyl)-3-(3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)propanamide |
| Molecular Weight: | 412.82 |
| Molecular Formula: | C17 H14 Cl F N2 O5 S |
| Smiles: | C(CS(c1ccc2c(c1)NC(CO2)=O)(=O)=O)C(Nc1ccc(cc1F)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 1.6616 |
| logD: | 1.5804 |
| logSw: | -2.7598 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.725 |
| InChI Key: | KHNNFSQZVOQWPO-UHFFFAOYSA-N |