N-(4-fluorophenyl)-2-{[3-(3-methoxyphenyl)-6-methyl-7-oxo-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(4-fluorophenyl)-2-{[3-(3-methoxyphenyl)-6-methyl-7-oxo-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}acetamide
N-(4-fluorophenyl)-2-{[3-(3-methoxyphenyl)-6-methyl-7-oxo-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | F143-0357 |
| Compound Name: | N-(4-fluorophenyl)-2-{[3-(3-methoxyphenyl)-6-methyl-7-oxo-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}acetamide |
| Molecular Weight: | 488.58 |
| Molecular Formula: | C21 H17 F N4 O3 S3 |
| Smiles: | CN1C(=NC2=C(C1=O)SC(N2c1cccc(c1)OC)=S)SCC(Nc1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7234 |
| logD: | 3.7233 |
| logSw: | -4.1817 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.296 |
| InChI Key: | OBRQYAGONBVGHH-UHFFFAOYSA-N |