1-[4-(3-chlorophenyl)piperazin-1-yl]-2-{[5-methyl-2-(pyridin-3-yl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]amino}ethan-1-one
Chemical Structure Depiction of
1-[4-(3-chlorophenyl)piperazin-1-yl]-2-{[5-methyl-2-(pyridin-3-yl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]amino}ethan-1-one
1-[4-(3-chlorophenyl)piperazin-1-yl]-2-{[5-methyl-2-(pyridin-3-yl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]amino}ethan-1-one
Compound characteristics
| Compound ID: | D494-0502 |
| Compound Name: | 1-[4-(3-chlorophenyl)piperazin-1-yl]-2-{[5-methyl-2-(pyridin-3-yl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]amino}ethan-1-one |
| Molecular Weight: | 462.94 |
| Molecular Formula: | C23 H23 Cl N8 O |
| Smiles: | Cc1cc(NCC(N2CCN(CC2)c2cccc(c2)[Cl])=O)n2c(n1)nc(c1cccnc1)n2 |
| Stereo: | ACHIRAL |
| logP: | 2.3113 |
| logD: | 2.1685 |
| logSw: | -3.4518 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.333 |
| InChI Key: | KYALRBFCNRZGLQ-UHFFFAOYSA-N |