5-{[2-(2-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-3-phenyl-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Chemical Structure Depiction of
5-{[2-(2-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-3-phenyl-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
5-{[2-(2-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-3-phenyl-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Compound characteristics
| Compound ID: | F092-0404 |
| Compound Name: | 5-{[2-(2-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-3-phenyl-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one |
| Molecular Weight: | 432.58 |
| Molecular Formula: | C19 H20 N4 O2 S3 |
| Smiles: | CC1CCCCN1C(CSC1NC(C2=C(N=1)N(C(=S)S2)c1ccccc1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7535 |
| logD: | 2.7518 |
| logSw: | -3.2798 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.973 |
| InChI Key: | XXTBZTMCRSWOSY-LBPRGKRZSA-N |