{4-[3-(4-methylphenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]piperazin-1-yl}{4-[(propan-2-yl)oxy]phenyl}methanone
Chemical Structure Depiction of
{4-[3-(4-methylphenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]piperazin-1-yl}{4-[(propan-2-yl)oxy]phenyl}methanone
{4-[3-(4-methylphenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]piperazin-1-yl}{4-[(propan-2-yl)oxy]phenyl}methanone
Compound characteristics
| Compound ID: | G866-0182 |
| Compound Name: | {4-[3-(4-methylphenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]piperazin-1-yl}{4-[(propan-2-yl)oxy]phenyl}methanone |
| Molecular Weight: | 457.53 |
| Molecular Formula: | C25 H27 N7 O2 |
| Smiles: | CC(C)Oc1ccc(cc1)C(N1CCN(CC1)c1c2c(ncn1)n(c1ccc(C)cc1)nn2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7253 |
| logD: | 3.7252 |
| logSw: | -3.9675 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 73.884 |
| InChI Key: | AYOWDIGSEMXLFL-UHFFFAOYSA-N |