N-(3-chloro-4-methoxyphenyl)-2-[4-(3-hydroxy-3-methylbut-1-yn-1-yl)phenyl]-1,3-thiazolidine-3-carbothioamide
Chemical Structure Depiction of
N-(3-chloro-4-methoxyphenyl)-2-[4-(3-hydroxy-3-methylbut-1-yn-1-yl)phenyl]-1,3-thiazolidine-3-carbothioamide
N-(3-chloro-4-methoxyphenyl)-2-[4-(3-hydroxy-3-methylbut-1-yn-1-yl)phenyl]-1,3-thiazolidine-3-carbothioamide
Compound characteristics
| Compound ID: | 8015-1943 |
| Compound Name: | N-(3-chloro-4-methoxyphenyl)-2-[4-(3-hydroxy-3-methylbut-1-yn-1-yl)phenyl]-1,3-thiazolidine-3-carbothioamide |
| Molecular Weight: | 447.02 |
| Molecular Formula: | C22 H23 Cl N2 O2 S2 |
| Smiles: | CC(C)(C#Cc1ccc(cc1)C1N(CCS1)C(Nc1ccc(c(c1)[Cl])OC)=S)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.6543 |
| logD: | 5.6543 |
| logSw: | -5.7611 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 34.745 |
| InChI Key: | ZARWCSOWOYLBHI-FQEVSTJZSA-N |