(2E)-2-benzylidene-6-(3,5-dimethylpiperidine-1-carbonyl)-4-[(3-methylphenyl)methyl]-2H-1,4-benzothiazin-3(4H)-one
Chemical Structure Depiction of
(2E)-2-benzylidene-6-(3,5-dimethylpiperidine-1-carbonyl)-4-[(3-methylphenyl)methyl]-2H-1,4-benzothiazin-3(4H)-one
(2E)-2-benzylidene-6-(3,5-dimethylpiperidine-1-carbonyl)-4-[(3-methylphenyl)methyl]-2H-1,4-benzothiazin-3(4H)-one
Compound characteristics
| Compound ID: | C700-0510 |
| Compound Name: | (2E)-2-benzylidene-6-(3,5-dimethylpiperidine-1-carbonyl)-4-[(3-methylphenyl)methyl]-2H-1,4-benzothiazin-3(4H)-one |
| Molecular Weight: | 496.67 |
| Molecular Formula: | C31 H32 N2 O2 S |
| Smiles: | CC1CC(C)CN(C1)C(c1ccc2c(c1)N(Cc1cccc(C)c1)C(/C(=C\c1ccccc1)S2)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 7.1023 |
| logD: | 7.1023 |
| logSw: | -5.5924 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 31.5847 |
| InChI Key: | RFUBVTANCZAJAW-UHFFFAOYSA-N |