3-(4-chlorophenyl)-6-methyl-5-{[(2-methylphenyl)methyl]sulfanyl}-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Chemical Structure Depiction of
3-(4-chlorophenyl)-6-methyl-5-{[(2-methylphenyl)methyl]sulfanyl}-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
3-(4-chlorophenyl)-6-methyl-5-{[(2-methylphenyl)methyl]sulfanyl}-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Compound characteristics
| Compound ID: | F143-0282 |
| Compound Name: | 3-(4-chlorophenyl)-6-methyl-5-{[(2-methylphenyl)methyl]sulfanyl}-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one |
| Molecular Weight: | 446.01 |
| Molecular Formula: | C20 H16 Cl N3 O S3 |
| Smiles: | Cc1ccccc1CSC1=NC2=C(C(N1C)=O)SC(N2c1ccc(cc1)[Cl])=S |
| Stereo: | ACHIRAL |
| logP: | 5.5274 |
| logD: | 5.5274 |
| logSw: | -5.9116 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 27.6032 |
| InChI Key: | KVSDWNOMMWKOSB-UHFFFAOYSA-N |