4-({4-[(2,5-dimethylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)-N-[2-(2-methylpiperidin-1-yl)ethyl]benzamide
Chemical Structure Depiction of
4-({4-[(2,5-dimethylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)-N-[2-(2-methylpiperidin-1-yl)ethyl]benzamide
4-({4-[(2,5-dimethylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)-N-[2-(2-methylpiperidin-1-yl)ethyl]benzamide
Compound characteristics
| Compound ID: | C700-0507 |
| Compound Name: | 4-({4-[(2,5-dimethylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)-N-[2-(2-methylpiperidin-1-yl)ethyl]benzamide |
| Molecular Weight: | 539.74 |
| Molecular Formula: | C33 H37 N3 O2 S |
| Smiles: | CC1CCCCN1CCNC(c1ccc(\C=C2/C(N(Cc3cc(C)ccc3C)c3ccccc3S2)=O)cc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.4248 |
| logD: | 5.192 |
| logSw: | -5.516 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.758 |
| InChI Key: | IJNHMGLHNHLUHN-VWLOTQADSA-N |