3-(3-methoxyphenyl)-6-(4-methylphenyl)-5-{[(pyridin-3-yl)methyl]sulfanyl}-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Chemical Structure Depiction of
3-(3-methoxyphenyl)-6-(4-methylphenyl)-5-{[(pyridin-3-yl)methyl]sulfanyl}-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
3-(3-methoxyphenyl)-6-(4-methylphenyl)-5-{[(pyridin-3-yl)methyl]sulfanyl}-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Compound characteristics
| Compound ID: | K286-3861 |
| Compound Name: | 3-(3-methoxyphenyl)-6-(4-methylphenyl)-5-{[(pyridin-3-yl)methyl]sulfanyl}-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one |
| Molecular Weight: | 504.65 |
| Molecular Formula: | C25 H20 N4 O2 S3 |
| Smiles: | Cc1ccc(cc1)N1C(=NC2=C(C1=O)SC(N2c1cccc(c1)OC)=S)SCc1cccnc1 |
| Stereo: | ACHIRAL |
| logP: | 4.8074 |
| logD: | 4.7948 |
| logSw: | -4.3941 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 44.016 |
| InChI Key: | BCZMKRVBFPDQCX-UHFFFAOYSA-N |