2-{[4-(4-benzylpiperidine-1-carbonyl)phenyl]methylidene}-4-[(3-chlorophenyl)methyl]-2H-1,4-benzothiazin-3(4H)-one
Chemical Structure Depiction of
2-{[4-(4-benzylpiperidine-1-carbonyl)phenyl]methylidene}-4-[(3-chlorophenyl)methyl]-2H-1,4-benzothiazin-3(4H)-one
2-{[4-(4-benzylpiperidine-1-carbonyl)phenyl]methylidene}-4-[(3-chlorophenyl)methyl]-2H-1,4-benzothiazin-3(4H)-one
Compound characteristics
| Compound ID: | K788-8965 |
| Compound Name: | 2-{[4-(4-benzylpiperidine-1-carbonyl)phenyl]methylidene}-4-[(3-chlorophenyl)methyl]-2H-1,4-benzothiazin-3(4H)-one |
| Molecular Weight: | 579.16 |
| Molecular Formula: | C35 H31 Cl N2 O2 S |
| Smiles: | C1CN(CCC1Cc1ccccc1)C(c1ccc(\C=C2/C(N(Cc3cccc(c3)[Cl])c3ccccc3S2)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 8.1832 |
| logD: | 8.1832 |
| logSw: | -6.6049 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 31.4463 |
| InChI Key: | QNWQVVLTDRDFHL-UHFFFAOYSA-N |