2-[3-oxo-4-(prop-2-en-1-yl)-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene]-N-(pentan-3-yl)acetamide
Chemical Structure Depiction of
2-[3-oxo-4-(prop-2-en-1-yl)-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene]-N-(pentan-3-yl)acetamide
2-[3-oxo-4-(prop-2-en-1-yl)-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene]-N-(pentan-3-yl)acetamide
Compound characteristics
| Compound ID: | V010-0046 |
| Compound Name: | 2-[3-oxo-4-(prop-2-en-1-yl)-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene]-N-(pentan-3-yl)acetamide |
| Molecular Weight: | 330.45 |
| Molecular Formula: | C18 H22 N2 O2 S |
| Smiles: | CCC(CC)NC(\C=C1/C(N(CC=C)c2ccccc2S1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3263 |
| logD: | 4.3263 |
| logSw: | -4.2367 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.971 |
| InChI Key: | PGSLRVYTRBSMFE-UHFFFAOYSA-N |