[4-(3-ethyl-5-methyl[1,2,4]triazolo[4,3-a]pyrimidin-7-yl)piperazin-1-yl](isoquinolin-1-yl)methanone
Chemical Structure Depiction of
[4-(3-ethyl-5-methyl[1,2,4]triazolo[4,3-a]pyrimidin-7-yl)piperazin-1-yl](isoquinolin-1-yl)methanone
[4-(3-ethyl-5-methyl[1,2,4]triazolo[4,3-a]pyrimidin-7-yl)piperazin-1-yl](isoquinolin-1-yl)methanone
Compound characteristics
| Compound ID: | P664-0461 |
| Compound Name: | [4-(3-ethyl-5-methyl[1,2,4]triazolo[4,3-a]pyrimidin-7-yl)piperazin-1-yl](isoquinolin-1-yl)methanone |
| Molecular Weight: | 401.47 |
| Molecular Formula: | C22 H23 N7 O |
| Smiles: | CCc1nnc2nc(cc(C)n12)N1CCN(CC1)C(c1c2ccccc2ccn1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.436 |
| logD: | 2.4359 |
| logSw: | -2.9232 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 61.431 |
| InChI Key: | JIRINHOTWQSRHV-UHFFFAOYSA-N |