6-methyl-3-(4-methylphenyl)-2-sulfanylidene-5-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Chemical Structure Depiction of
6-methyl-3-(4-methylphenyl)-2-sulfanylidene-5-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
6-methyl-3-(4-methylphenyl)-2-sulfanylidene-5-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Compound characteristics
| Compound ID: | F143-0102 |
| Compound Name: | 6-methyl-3-(4-methylphenyl)-2-sulfanylidene-5-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one |
| Molecular Weight: | 479.56 |
| Molecular Formula: | C21 H16 F3 N3 O S3 |
| Smiles: | Cc1ccc(cc1)N1C2=C(C(N(C)C(=N2)SCc2cccc(c2)C(F)(F)F)=O)SC1=S |
| Stereo: | ACHIRAL |
| logP: | 5.3127 |
| logD: | 5.3127 |
| logSw: | -5.3979 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 27.6032 |
| InChI Key: | DUKYWPJTJBDAJV-UHFFFAOYSA-N |