3-(2-methylphenyl)-6-(4-methylphenyl)-5-(methylsulfanyl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Chemical Structure Depiction of
3-(2-methylphenyl)-6-(4-methylphenyl)-5-(methylsulfanyl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
3-(2-methylphenyl)-6-(4-methylphenyl)-5-(methylsulfanyl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Compound characteristics
| Compound ID: | K286-3831 |
| Compound Name: | 3-(2-methylphenyl)-6-(4-methylphenyl)-5-(methylsulfanyl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one |
| Molecular Weight: | 411.56 |
| Molecular Formula: | C20 H17 N3 O S3 |
| Smiles: | Cc1ccc(cc1)N1C(=NC2=C(C1=O)SC(N2c1ccccc1C)=S)SC |
| Stereo: | ACHIRAL |
| logP: | 4.8335 |
| logD: | 4.8335 |
| logSw: | -4.6167 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 26.9251 |
| InChI Key: | ZJLKHUPGNJZOLL-UHFFFAOYSA-N |