ethyl 1-[4-({4-[(3-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)benzoyl]piperidine-4-carboxylate
Chemical Structure Depiction of
ethyl 1-[4-({4-[(3-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)benzoyl]piperidine-4-carboxylate
ethyl 1-[4-({4-[(3-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)benzoyl]piperidine-4-carboxylate
Compound characteristics
| Compound ID: | K788-9120 |
| Compound Name: | ethyl 1-[4-({4-[(3-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)benzoyl]piperidine-4-carboxylate |
| Molecular Weight: | 540.68 |
| Molecular Formula: | C32 H32 N2 O4 S |
| Smiles: | CCOC(C1CCN(CC1)C(c1ccc(\C=C2/C(N(Cc3cccc(C)c3)c3ccccc3S2)=O)cc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.1161 |
| logD: | 6.1161 |
| logSw: | -5.4381 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 52.472 |
| InChI Key: | PCCLNXDUVNWMJC-UHFFFAOYSA-N |