1-{4-[3-(4-chlorophenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]piperazin-1-yl}-3-(4-methoxyphenyl)propan-1-one
Chemical Structure Depiction of
1-{4-[3-(4-chlorophenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]piperazin-1-yl}-3-(4-methoxyphenyl)propan-1-one
1-{4-[3-(4-chlorophenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]piperazin-1-yl}-3-(4-methoxyphenyl)propan-1-one
Compound characteristics
| Compound ID: | G866-0661 |
| Compound Name: | 1-{4-[3-(4-chlorophenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]piperazin-1-yl}-3-(4-methoxyphenyl)propan-1-one |
| Molecular Weight: | 477.95 |
| Molecular Formula: | C24 H24 Cl N7 O2 |
| Smiles: | COc1ccc(CCC(N2CCN(CC2)c2c3c(ncn2)n(c2ccc(cc2)[Cl])nn3)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.8005 |
| logD: | 3.8005 |
| logSw: | -4.3533 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 74.098 |
| InChI Key: | VMNGFLYBHUXVIV-UHFFFAOYSA-N |