1-{4-[7-(4-tert-butylphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]piperazin-1-yl}-2-(4-chlorophenoxy)ethan-1-one
Chemical Structure Depiction of
1-{4-[7-(4-tert-butylphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]piperazin-1-yl}-2-(4-chlorophenoxy)ethan-1-one
1-{4-[7-(4-tert-butylphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]piperazin-1-yl}-2-(4-chlorophenoxy)ethan-1-one
Compound characteristics
| Compound ID: | V010-0648 |
| Compound Name: | 1-{4-[7-(4-tert-butylphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]piperazin-1-yl}-2-(4-chlorophenoxy)ethan-1-one |
| Molecular Weight: | 505.02 |
| Molecular Formula: | C27 H29 Cl N6 O2 |
| Salt: | not_available |
| Smiles: | CC(C)(C)c1ccc(cc1)c1ccnc2nc(nn12)N1CCN(CC1)C(COc1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.2745 |
| logD: | 5.2724 |
| logSw: | -5.9177 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 56.02 |
| InChI Key: | SWJHXLMLMOXHEP-UHFFFAOYSA-N |