methyl 2-benzylidene-4-[(2-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxylate
Chemical Structure Depiction of
methyl 2-benzylidene-4-[(2-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxylate
methyl 2-benzylidene-4-[(2-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxylate
Compound characteristics
| Compound ID: | K783-6567 |
| Compound Name: | methyl 2-benzylidene-4-[(2-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxylate |
| Molecular Weight: | 415.51 |
| Molecular Formula: | C25 H21 N O3 S |
| Smiles: | Cc1ccccc1CN1C(/C(=C\c2ccccc2)Sc2ccc(cc12)C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 6.3359 |
| logD: | 6.3359 |
| logSw: | -5.4658 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 36.243 |
| InChI Key: | IOFLVGROTAIOHY-OEAKJJBVSA-N |