ethyl 3-{7-[4-(2-chlorobenzoyl)piperazin-1-yl]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}propanoate
Chemical Structure Depiction of
ethyl 3-{7-[4-(2-chlorobenzoyl)piperazin-1-yl]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}propanoate
ethyl 3-{7-[4-(2-chlorobenzoyl)piperazin-1-yl]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}propanoate
Compound characteristics
Compound ID: | V019-1390 |
Compound Name: | ethyl 3-{7-[4-(2-chlorobenzoyl)piperazin-1-yl]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}propanoate |
Molecular Weight: | 456.93 |
Molecular Formula: | C22 H25 Cl N6 O3 |
Salt: | not_available |
Smiles: | CCOC(CCc1c(C)nc2ncnn2c1N1CCN(CC1)C(c1ccccc1[Cl])=O)=O |
Stereo: | ACHIRAL |
logP: | 2.6849 |
logD: | 2.6555 |
logSw: | -3.5496 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 71.19 |
InChI Key: | QWOUGEIOOXLFCQ-UHFFFAOYSA-N |