N-(2,4-dimethylpentan-3-yl)-2-{4-[(3-methoxyphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}acetamide
Chemical Structure Depiction of
N-(2,4-dimethylpentan-3-yl)-2-{4-[(3-methoxyphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}acetamide
N-(2,4-dimethylpentan-3-yl)-2-{4-[(3-methoxyphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}acetamide
Compound characteristics
| Compound ID: | V007-3252 |
| Compound Name: | N-(2,4-dimethylpentan-3-yl)-2-{4-[(3-methoxyphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}acetamide |
| Molecular Weight: | 438.59 |
| Molecular Formula: | C25 H30 N2 O3 S |
| Smiles: | CC(C)C(C(C)C)NC(\C=C1/C(N(Cc2cccc(c2)OC)c2ccccc2S1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.1972 |
| logD: | 6.1972 |
| logSw: | -5.3565 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.708 |
| InChI Key: | BMEBPBJBKGJKMT-UHFFFAOYSA-N |