N-[(furan-2-yl)methyl]-2-{[3-(3-methoxyphenyl)-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-[(furan-2-yl)methyl]-2-{[3-(3-methoxyphenyl)-7-oxo-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}acetamide
N-[(furan-2-yl)methyl]-2-{[3-(3-methoxyphenyl)-7-oxo-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | F092-0082 |
| Compound Name: | N-[(furan-2-yl)methyl]-2-{[3-(3-methoxyphenyl)-7-oxo-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}acetamide |
| Molecular Weight: | 460.55 |
| Molecular Formula: | C19 H16 N4 O4 S3 |
| Smiles: | COc1cccc(c1)N1C2=C(C(NC(=N2)SCC(NCc2ccco2)=O)=O)SC1=S |
| Stereo: | ACHIRAL |
| logP: | 2.8817 |
| logD: | 2.8801 |
| logSw: | -3.4901 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.06 |
| InChI Key: | IIXVNWKRJLIXOB-UHFFFAOYSA-N |