ethyl 3-{7-[4-(4-cyanobenzoyl)piperazin-1-yl]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}propanoate
Chemical Structure Depiction of
ethyl 3-{7-[4-(4-cyanobenzoyl)piperazin-1-yl]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}propanoate
ethyl 3-{7-[4-(4-cyanobenzoyl)piperazin-1-yl]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}propanoate
Compound characteristics
| Compound ID: | V002-0603 |
| Compound Name: | ethyl 3-{7-[4-(4-cyanobenzoyl)piperazin-1-yl]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}propanoate |
| Molecular Weight: | 447.5 |
| Molecular Formula: | C23 H25 N7 O3 |
| Salt: | not_available |
| Smiles: | CCOC(CCc1c(C)nc2ncnn2c1N1CCN(CC1)C(c1ccc(C#N)cc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9254 |
| logD: | 1.896 |
| logSw: | -2.2084 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 88.246 |
| InChI Key: | MEJCWDCGCUGXFS-UHFFFAOYSA-N |