N-[(furan-2-yl)methyl]-2-{[6-(2-methoxyphenyl)-7-oxo-3-phenyl-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-{[6-(2-methoxyphenyl)-7-oxo-3-phenyl-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}acetamide
N-[(furan-2-yl)methyl]-2-{[6-(2-methoxyphenyl)-7-oxo-3-phenyl-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | K286-0124 |
| Compound Name: | N-[(furan-2-yl)methyl]-2-{[6-(2-methoxyphenyl)-7-oxo-3-phenyl-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}acetamide |
| Molecular Weight: | 536.65 |
| Molecular Formula: | C25 H20 N4 O4 S3 |
| Smiles: | COc1ccccc1N1C(=NC2=C(C1=O)SC(N2c1ccccc1)=S)SCC(NCc1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0774 |
| logD: | 4.0774 |
| logSw: | -4.2262 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.504 |
| InChI Key: | VMXIAUJHLLSKPZ-UHFFFAOYSA-N |