N-(3-chloro-2-methylphenyl)-3-(3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonyl)propanamide
Chemical Structure Depiction of
N-(3-chloro-2-methylphenyl)-3-(3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonyl)propanamide
N-(3-chloro-2-methylphenyl)-3-(3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonyl)propanamide
Compound characteristics
| Compound ID: | E511-1089 |
| Compound Name: | N-(3-chloro-2-methylphenyl)-3-(3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonyl)propanamide |
| Molecular Weight: | 424.92 |
| Molecular Formula: | C18 H17 Cl N2 O4 S2 |
| Smiles: | Cc1c(cccc1[Cl])NC(CCS(c1ccc2c(c1)NC(CS2)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3169 |
| logD: | 2.3144 |
| logSw: | -3.1216 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.275 |
| InChI Key: | PKQGRLHUXZKGGP-UHFFFAOYSA-N |