1-[(3-methylphenyl)methyl]-3-{[3-(trifluoromethyl)anilino]methylidene}-2lambda~6~,1-benzothiazine-2,2,4(1H,3H)-trione
Chemical Structure Depiction of
1-[(3-methylphenyl)methyl]-3-{[3-(trifluoromethyl)anilino]methylidene}-2lambda~6~,1-benzothiazine-2,2,4(1H,3H)-trione
1-[(3-methylphenyl)methyl]-3-{[3-(trifluoromethyl)anilino]methylidene}-2lambda~6~,1-benzothiazine-2,2,4(1H,3H)-trione
Compound characteristics
| Compound ID: | C200-4297 |
| Compound Name: | 1-[(3-methylphenyl)methyl]-3-{[3-(trifluoromethyl)anilino]methylidene}-2lambda~6~,1-benzothiazine-2,2,4(1H,3H)-trione |
| Molecular Weight: | 472.48 |
| Molecular Formula: | C24 H19 F3 N2 O3 S |
| Smiles: | Cc1cccc(CN2c3ccccc3C(/C(=C\Nc3cccc(c3)C(F)(F)F)S2(=O)=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 5.5815 |
| logD: | 5.5773 |
| logSw: | -5.6312 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.509 |
| InChI Key: | ORCJZXPHLQSSJX-UHFFFAOYSA-N |