3-(3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonyl)-N-(3,4,5-trimethoxyphenyl)propanamide
Chemical Structure Depiction of
3-(3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonyl)-N-(3,4,5-trimethoxyphenyl)propanamide
3-(3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonyl)-N-(3,4,5-trimethoxyphenyl)propanamide
Compound characteristics
| Compound ID: | E511-1088 |
| Compound Name: | 3-(3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonyl)-N-(3,4,5-trimethoxyphenyl)propanamide |
| Molecular Weight: | 466.53 |
| Molecular Formula: | C20 H22 N2 O7 S2 |
| Smiles: | COc1cc(cc(c1OC)OC)NC(CCS(c1ccc2c(c1)NC(CS2)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.8901 |
| logD: | 0.8865 |
| logSw: | -2.2545 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 99.951 |
| InChI Key: | JMXCWNKVLVSBBE-UHFFFAOYSA-N |