{4-[3-(4-chlorophenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]piperazin-1-yl}(phenyl)methanone
Chemical Structure Depiction of
{4-[3-(4-chlorophenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]piperazin-1-yl}(phenyl)methanone
{4-[3-(4-chlorophenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]piperazin-1-yl}(phenyl)methanone
Compound characteristics
| Compound ID: | G866-0575 |
| Compound Name: | {4-[3-(4-chlorophenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]piperazin-1-yl}(phenyl)methanone |
| Molecular Weight: | 419.87 |
| Molecular Formula: | C21 H18 Cl N7 O |
| Smiles: | C1CN(CCN1C(c1ccccc1)=O)c1c2c(ncn1)n(c1ccc(cc1)[Cl])nn2 |
| Stereo: | ACHIRAL |
| logP: | 3.125 |
| logD: | 3.125 |
| logSw: | -3.3962 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 67.081 |
| InChI Key: | HTUALJAWBVHSAM-UHFFFAOYSA-N |