3-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-[3-(1,2-oxazol-5-yl)phenyl]propanamide
Chemical Structure Depiction of
3-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-[3-(1,2-oxazol-5-yl)phenyl]propanamide
3-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-[3-(1,2-oxazol-5-yl)phenyl]propanamide
Compound characteristics
| Compound ID: | E667-1008 |
| Compound Name: | 3-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-[3-(1,2-oxazol-5-yl)phenyl]propanamide |
| Molecular Weight: | 461.88 |
| Molecular Formula: | C20 H16 Cl N3 O6 S |
| Smiles: | C(CS(c1cc2c(cc1[Cl])NC(CO2)=O)(=O)=O)C(Nc1cccc(c1)c1ccno1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9021 |
| logD: | 1.8806 |
| logSw: | -3.0737 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 107.292 |
| InChI Key: | FCNPNYNKZUNQRU-UHFFFAOYSA-N |