6-(4-fluorophenyl)-3-(3-methoxyphenyl)-5-{[(oxolan-2-yl)methyl]sulfanyl}-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Chemical Structure Depiction of
6-(4-fluorophenyl)-3-(3-methoxyphenyl)-5-{[(oxolan-2-yl)methyl]sulfanyl}-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
6-(4-fluorophenyl)-3-(3-methoxyphenyl)-5-{[(oxolan-2-yl)methyl]sulfanyl}-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Compound characteristics
| Compound ID: | K286-0755 |
| Compound Name: | 6-(4-fluorophenyl)-3-(3-methoxyphenyl)-5-{[(oxolan-2-yl)methyl]sulfanyl}-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one |
| Molecular Weight: | 501.62 |
| Molecular Formula: | C23 H20 F N3 O3 S3 |
| Smiles: | COc1cccc(c1)N1C2=C(C(N(C(=N2)SCC2CCCO2)c2ccc(cc2)F)=O)SC1=S |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3423 |
| logD: | 4.3423 |
| logSw: | -4.4464 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 43.153 |
| InChI Key: | IMDWIHCPRAJBNO-GOSISDBHSA-N |