{4-[7-(2H-1,3-benzodioxol-5-yl)[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]piperazin-1-yl}(3-chlorophenyl)methanone
Chemical Structure Depiction of
{4-[7-(2H-1,3-benzodioxol-5-yl)[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]piperazin-1-yl}(3-chlorophenyl)methanone
{4-[7-(2H-1,3-benzodioxol-5-yl)[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]piperazin-1-yl}(3-chlorophenyl)methanone
Compound characteristics
| Compound ID: | V004-0358 |
| Compound Name: | {4-[7-(2H-1,3-benzodioxol-5-yl)[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]piperazin-1-yl}(3-chlorophenyl)methanone |
| Molecular Weight: | 462.89 |
| Molecular Formula: | C23 H19 Cl N6 O3 |
| Smiles: | C1CN(CCN1C(c1cccc(c1)[Cl])=O)c1nc2nccc(c3ccc4c(c3)OCO4)n2n1 |
| Stereo: | ACHIRAL |
| logP: | 3.4816 |
| logD: | 3.4816 |
| logSw: | -3.7338 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 66.164 |
| InChI Key: | BQPFACQVUUBDDA-UHFFFAOYSA-N |