3-[2-(diethylamino)ethyl]-5-{[(2,5-difluorophenyl)methyl]sulfanyl}-6-(2-methoxyphenyl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Chemical Structure Depiction of
3-[2-(diethylamino)ethyl]-5-{[(2,5-difluorophenyl)methyl]sulfanyl}-6-(2-methoxyphenyl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
3-[2-(diethylamino)ethyl]-5-{[(2,5-difluorophenyl)methyl]sulfanyl}-6-(2-methoxyphenyl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Compound characteristics
| Compound ID: | K286-3496 |
| Compound Name: | 3-[2-(diethylamino)ethyl]-5-{[(2,5-difluorophenyl)methyl]sulfanyl}-6-(2-methoxyphenyl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one |
| Molecular Weight: | 548.7 |
| Molecular Formula: | C25 H26 F2 N4 O2 S3 |
| Smiles: | CCN(CC)CCN1C2=C(C(N(C(=N2)SCc2cc(ccc2F)F)c2ccccc2OC)=O)SC1=S |
| Stereo: | ACHIRAL |
| logP: | 5.4516 |
| logD: | 3.5775 |
| logSw: | -5.2953 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 38.557 |
| InChI Key: | FPDAFXXCJALHBI-UHFFFAOYSA-N |