4-[(3-methylphenyl)methyl]-3-oxo-N-(prop-2-en-1-yl)-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Chemical Structure Depiction of
4-[(3-methylphenyl)methyl]-3-oxo-N-(prop-2-en-1-yl)-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
4-[(3-methylphenyl)methyl]-3-oxo-N-(prop-2-en-1-yl)-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Compound characteristics
| Compound ID: | K784-8602 |
| Compound Name: | 4-[(3-methylphenyl)methyl]-3-oxo-N-(prop-2-en-1-yl)-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide |
| Molecular Weight: | 352.45 |
| Molecular Formula: | C20 H20 N2 O2 S |
| Smiles: | Cc1cccc(CN2C(CSc3ccc(cc23)C(NCC=C)=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.4458 |
| logD: | 3.4458 |
| logSw: | -3.8218 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.145 |
| InChI Key: | NKAIAVBNYAEODH-UHFFFAOYSA-N |