ethyl 1-{2-benzylidene-4-[(3-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carbonyl}piperidine-4-carboxylate
Chemical Structure Depiction of
ethyl 1-{2-benzylidene-4-[(3-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carbonyl}piperidine-4-carboxylate
ethyl 1-{2-benzylidene-4-[(3-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carbonyl}piperidine-4-carboxylate
Compound characteristics
| Compound ID: | C700-0509 |
| Compound Name: | ethyl 1-{2-benzylidene-4-[(3-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carbonyl}piperidine-4-carboxylate |
| Molecular Weight: | 540.68 |
| Molecular Formula: | C32 H32 N2 O4 S |
| Smiles: | CCOC(C1CCN(CC1)C(c1ccc2c(c1)N(Cc1cccc(C)c1)C(/C(=C\c1ccccc1)S2)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.1339 |
| logD: | 6.1339 |
| logSw: | -5.4439 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 52.472 |
| InChI Key: | JEXYNNYNBWGBSG-UHFFFAOYSA-N |