2-{[4-(4-benzylpiperidine-1-carbonyl)phenyl]methylidene}-4-[(2-methylphenyl)methyl]-2H-1,4-benzothiazin-3(4H)-one
Chemical Structure Depiction of
2-{[4-(4-benzylpiperidine-1-carbonyl)phenyl]methylidene}-4-[(2-methylphenyl)methyl]-2H-1,4-benzothiazin-3(4H)-one
2-{[4-(4-benzylpiperidine-1-carbonyl)phenyl]methylidene}-4-[(2-methylphenyl)methyl]-2H-1,4-benzothiazin-3(4H)-one
Compound characteristics
| Compound ID: | K788-9065 |
| Compound Name: | 2-{[4-(4-benzylpiperidine-1-carbonyl)phenyl]methylidene}-4-[(2-methylphenyl)methyl]-2H-1,4-benzothiazin-3(4H)-one |
| Molecular Weight: | 558.74 |
| Molecular Formula: | C36 H34 N2 O2 S |
| Smiles: | Cc1ccccc1CN1C(/C(=C\c2ccc(cc2)C(N2CCC(CC2)Cc2ccccc2)=O)Sc2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 8.1464 |
| logD: | 8.1464 |
| logSw: | -5.8279 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 31.4463 |
| InChI Key: | HVCWLFDEOCWEIQ-UHFFFAOYSA-N |