N-butyl-2-{2-[(3-chlorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl}acetamide
Chemical Structure Depiction of
N-butyl-2-{2-[(3-chlorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl}acetamide
N-butyl-2-{2-[(3-chlorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl}acetamide
Compound characteristics
| Compound ID: | C312-0243 |
| Compound Name: | N-butyl-2-{2-[(3-chlorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl}acetamide |
| Molecular Weight: | 400.93 |
| Molecular Formula: | C21 H21 Cl N2 O2 S |
| Smiles: | CCCCNC(CN1C(/C(=C\c2cccc(c2)[Cl])Sc2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8211 |
| logD: | 4.8211 |
| logSw: | -4.673 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.654 |
| InChI Key: | OFXLSLRPWQXDOZ-UHFFFAOYSA-N |