1-(4-{2-chloro-4-[(6-ethyl-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)amino]phenyl}piperazin-1-yl)-2-methylpropan-1-one
Chemical Structure Depiction of
1-(4-{2-chloro-4-[(6-ethyl-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)amino]phenyl}piperazin-1-yl)-2-methylpropan-1-one
1-(4-{2-chloro-4-[(6-ethyl-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)amino]phenyl}piperazin-1-yl)-2-methylpropan-1-one
Compound characteristics
| Compound ID: | C301-7640 |
| Compound Name: | 1-(4-{2-chloro-4-[(6-ethyl-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)amino]phenyl}piperazin-1-yl)-2-methylpropan-1-one |
| Molecular Weight: | 441.96 |
| Molecular Formula: | C22 H28 Cl N7 O |
| Smiles: | CCc1c(C)nc2ncnn2c1Nc1ccc(c(c1)[Cl])N1CCN(CC1)C(C(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.122 |
| logD: | 4.1146 |
| logSw: | -4.3472 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.78 |
| InChI Key: | MZSZKXZPSUXFPN-UHFFFAOYSA-N |