4-({4-[(3-chlorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)-N-(3-methylbutyl)benzamide
Chemical Structure Depiction of
4-({4-[(3-chlorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)-N-(3-methylbutyl)benzamide
4-({4-[(3-chlorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)-N-(3-methylbutyl)benzamide
Compound characteristics
| Compound ID: | K788-8916 |
| Compound Name: | 4-({4-[(3-chlorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)-N-(3-methylbutyl)benzamide |
| Molecular Weight: | 491.05 |
| Molecular Formula: | C28 H27 Cl N2 O2 S |
| Smiles: | CC(C)CCNC(c1ccc(\C=C2/C(N(Cc3cccc(c3)[Cl])c3ccccc3S2)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.8237 |
| logD: | 6.8237 |
| logSw: | -6.2479 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.596 |
| InChI Key: | JKXNUGMFKOTVBM-UHFFFAOYSA-N |