{4-[7-(4-cyclohexylphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]piperazin-1-yl}[3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazol-4-yl]methanone
Chemical Structure Depiction of
{4-[7-(4-cyclohexylphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]piperazin-1-yl}[3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazol-4-yl]methanone
{4-[7-(4-cyclohexylphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]piperazin-1-yl}[3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazol-4-yl]methanone
Compound characteristics
| Compound ID: | V005-9498 |
| Compound Name: | {4-[7-(4-cyclohexylphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]piperazin-1-yl}[3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazol-4-yl]methanone |
| Molecular Weight: | 616.55 |
| Molecular Formula: | C32 H31 Cl2 N7 O2 |
| Salt: | not_available |
| Smiles: | Cc1c(C(N2CCN(CC2)c2nc3nccc(c4ccc(cc4)C4CCCCC4)n3n2)=O)c(c2c(cccc2[Cl])[Cl])no1 |
| Stereo: | ACHIRAL |
| logP: | 6.7433 |
| logD: | 6.7433 |
| logSw: | -6.4601 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 70.929 |
| InChI Key: | MSPJIUURNNZGRS-UHFFFAOYSA-N |