ethyl 3-{7-[4-(6-chloropyridine-3-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-(6-chloropyridine-3-carbonyl)piperazin-1-yl]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}propanoate
ethyl 3-{7-[4-(6-chloropyridine-3-carbonyl)piperazin-1-yl]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}propanoate
Compound characteristics
| Compound ID: | V031-0790 |
| Compound Name: | ethyl 3-{7-[4-(6-chloropyridine-3-carbonyl)piperazin-1-yl]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}propanoate |
| Molecular Weight: | 457.92 |
| Molecular Formula: | C21 H24 Cl N7 O3 |
| Salt: | not_available |
| Smiles: | CCOC(CCc1c(C)nc2ncnn2c1N1CCN(CC1)C(c1ccc(nc1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7634 |
| logD: | 1.734 |
| logSw: | -2.5796 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 80.194 |
| InChI Key: | OYBWFQBFOKIKFP-UHFFFAOYSA-N |