ethyl 1-[4-({4-[(3-chlorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)benzoyl]piperidine-3-carboxylate
Chemical Structure Depiction of
ethyl 1-[4-({4-[(3-chlorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)benzoyl]piperidine-3-carboxylate
ethyl 1-[4-({4-[(3-chlorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)benzoyl]piperidine-3-carboxylate
Compound characteristics
| Compound ID: | K788-8953 |
| Compound Name: | ethyl 1-[4-({4-[(3-chlorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)benzoyl]piperidine-3-carboxylate |
| Molecular Weight: | 561.1 |
| Molecular Formula: | C31 H29 Cl N2 O4 S |
| Smiles: | CCOC(C1CCCN(C1)C(c1ccc(\C=C2/C(N(Cc3cccc(c3)[Cl])c3ccccc3S2)=O)cc1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.161 |
| logD: | 6.161 |
| logSw: | -6.017 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 52.405 |
| InChI Key: | RCJNEDGPGDQQNW-DEOSSOPVSA-N |