ethyl 3-{7-[4-(1,3-dimethyl-1H-pyrazole-5-carbonyl)piperazin-1-yl]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}propanoate
Chemical Structure Depiction of
ethyl 3-{7-[4-(1,3-dimethyl-1H-pyrazole-5-carbonyl)piperazin-1-yl]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}propanoate
ethyl 3-{7-[4-(1,3-dimethyl-1H-pyrazole-5-carbonyl)piperazin-1-yl]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}propanoate
Compound characteristics
| Compound ID: | V001-6897 |
| Compound Name: | ethyl 3-{7-[4-(1,3-dimethyl-1H-pyrazole-5-carbonyl)piperazin-1-yl]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}propanoate |
| Molecular Weight: | 440.5 |
| Molecular Formula: | C21 H28 N8 O3 |
| Salt: | not_available |
| Smiles: | CCOC(CCc1c(C)nc2ncnn2c1N1CCN(CC1)C(c1cc(C)nn1C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.9278 |
| logD: | 0.8985 |
| logSw: | -1.3774 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 84.512 |
| InChI Key: | FCSPJEOGPWIWEH-UHFFFAOYSA-N |