3-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-(naphthalen-1-yl)propanamide
Chemical Structure Depiction of
3-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-(naphthalen-1-yl)propanamide
3-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-(naphthalen-1-yl)propanamide
Compound characteristics
| Compound ID: | E667-0989 |
| Compound Name: | 3-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-(naphthalen-1-yl)propanamide |
| Molecular Weight: | 444.89 |
| Molecular Formula: | C21 H17 Cl N2 O5 S |
| Smiles: | C(CS(c1cc2c(cc1[Cl])NC(CO2)=O)(=O)=O)C(Nc1cccc2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3977 |
| logD: | 2.3762 |
| logSw: | -3.2736 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.453 |
| InChI Key: | CNWQKCSIMBWANA-UHFFFAOYSA-N |