ethyl 4-[2-(8,9-dimethyl-2-oxothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-3(2H)-yl)acetamido]benzoate
Chemical Structure Depiction of
ethyl 4-[2-(8,9-dimethyl-2-oxothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-3(2H)-yl)acetamido]benzoate
ethyl 4-[2-(8,9-dimethyl-2-oxothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-3(2H)-yl)acetamido]benzoate
Compound characteristics
| Compound ID: | L908-0013 |
| Compound Name: | ethyl 4-[2-(8,9-dimethyl-2-oxothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-3(2H)-yl)acetamido]benzoate |
| Molecular Weight: | 425.46 |
| Molecular Formula: | C20 H19 N5 O4 S |
| Smiles: | CCOC(c1ccc(cc1)NC(CN1C(N=C2c3c(C)c(C)sc3N=CN12)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3019 |
| logD: | -1.1086 |
| logSw: | -3.5125 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.774 |
| InChI Key: | ULYUQQCDOKLACQ-UHFFFAOYSA-N |