N-(3,4-dimethoxyphenyl)-2-[3-oxo-8-(piperidin-1-yl)[1,3]thiazolo[5,4-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide
Chemical Structure Depiction of
N-(3,4-dimethoxyphenyl)-2-[3-oxo-8-(piperidin-1-yl)[1,3]thiazolo[5,4-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide
N-(3,4-dimethoxyphenyl)-2-[3-oxo-8-(piperidin-1-yl)[1,3]thiazolo[5,4-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide
Compound characteristics
| Compound ID: | M447-0464 |
| Compound Name: | N-(3,4-dimethoxyphenyl)-2-[3-oxo-8-(piperidin-1-yl)[1,3]thiazolo[5,4-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide |
| Molecular Weight: | 469.52 |
| Molecular Formula: | C21 H23 N7 O4 S |
| Smiles: | COc1ccc(cc1OC)NC(CN1C(N2C=Nc3c(C2=N1)sc(n3)N1CCCCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6992 |
| logD: | 2.6978 |
| logSw: | -3.1856 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 93.946 |
| InChI Key: | XKQDSUXLZCABLK-UHFFFAOYSA-N |