1-[(4-methylphenyl)methyl]-3-{[3-(trifluoromethyl)anilino]methylidene}-2lambda~6~-thieno[3,2-c][1,2]thiazine-2,2,4(1H,3H)-trione
Chemical Structure Depiction of
1-[(4-methylphenyl)methyl]-3-{[3-(trifluoromethyl)anilino]methylidene}-2lambda~6~-thieno[3,2-c][1,2]thiazine-2,2,4(1H,3H)-trione
1-[(4-methylphenyl)methyl]-3-{[3-(trifluoromethyl)anilino]methylidene}-2lambda~6~-thieno[3,2-c][1,2]thiazine-2,2,4(1H,3H)-trione
Compound characteristics
| Compound ID: | E953-0122 |
| Compound Name: | 1-[(4-methylphenyl)methyl]-3-{[3-(trifluoromethyl)anilino]methylidene}-2lambda~6~-thieno[3,2-c][1,2]thiazine-2,2,4(1H,3H)-trione |
| Molecular Weight: | 478.51 |
| Molecular Formula: | C22 H17 F3 N2 O3 S2 |
| Smiles: | Cc1ccc(CN2c3ccsc3C(/C(=C/Nc3cccc(c3)C(F)(F)F)S2(=O)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.4568 |
| logD: | 5.4505 |
| logSw: | -5.5579 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.528 |
| InChI Key: | OJIATGDSWCOJLM-UHFFFAOYSA-N |