5-({3-chloro-5-methoxy-4-[(prop-2-yn-1-yl)oxy]phenyl}methylidene)-3-[(4-fluorophenyl)methyl]-1,3-thiazolidine-2,4-dione
Chemical Structure Depiction of
5-({3-chloro-5-methoxy-4-[(prop-2-yn-1-yl)oxy]phenyl}methylidene)-3-[(4-fluorophenyl)methyl]-1,3-thiazolidine-2,4-dione
5-({3-chloro-5-methoxy-4-[(prop-2-yn-1-yl)oxy]phenyl}methylidene)-3-[(4-fluorophenyl)methyl]-1,3-thiazolidine-2,4-dione
Compound characteristics
| Compound ID: | 4032-1214 |
| Compound Name: | 5-({3-chloro-5-methoxy-4-[(prop-2-yn-1-yl)oxy]phenyl}methylidene)-3-[(4-fluorophenyl)methyl]-1,3-thiazolidine-2,4-dione |
| Molecular Weight: | 431.87 |
| Molecular Formula: | C21 H15 Cl F N O4 S |
| Smiles: | COc1cc(/C=C2/C(N(Cc3ccc(cc3)F)C(=O)S2)=O)cc(c1OCC#C)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.1495 |
| logD: | 5.1495 |
| logSw: | -5.6674 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 44.817 |
| InChI Key: | KVVOHZCRFTYQIN-UHFFFAOYSA-N |