5-{[4-(3,4-dihydroisoquinoline-2(1H)-carbonyl)phenyl]methylidene}-3-{[2-(trifluoromethyl)phenyl]methyl}-1,3-thiazolidine-2,4-dione
Chemical Structure Depiction of
5-{[4-(3,4-dihydroisoquinoline-2(1H)-carbonyl)phenyl]methylidene}-3-{[2-(trifluoromethyl)phenyl]methyl}-1,3-thiazolidine-2,4-dione
5-{[4-(3,4-dihydroisoquinoline-2(1H)-carbonyl)phenyl]methylidene}-3-{[2-(trifluoromethyl)phenyl]methyl}-1,3-thiazolidine-2,4-dione
Compound characteristics
| Compound ID: | V019-7558 |
| Compound Name: | 5-{[4-(3,4-dihydroisoquinoline-2(1H)-carbonyl)phenyl]methylidene}-3-{[2-(trifluoromethyl)phenyl]methyl}-1,3-thiazolidine-2,4-dione |
| Molecular Weight: | 522.55 |
| Molecular Formula: | C28 H21 F3 N2 O3 S |
| Smiles: | C1CN(Cc2ccccc12)C(c1ccc(/C=C2/C(N(Cc3ccccc3C(F)(F)F)C(=O)S2)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8208 |
| logD: | 5.8208 |
| logSw: | -5.9001 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 45.906 |
| InChI Key: | XDCXQGRZQXLXLS-UHFFFAOYSA-N |