{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}[5-(2-chlorophenyl)-2-phenylpyrazolo[1,5-a]pyrimidin-7-yl]methanone
Chemical Structure Depiction of
{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}[5-(2-chlorophenyl)-2-phenylpyrazolo[1,5-a]pyrimidin-7-yl]methanone
{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}[5-(2-chlorophenyl)-2-phenylpyrazolo[1,5-a]pyrimidin-7-yl]methanone
Compound characteristics
| Compound ID: | V010-1257 |
| Compound Name: | {4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}[5-(2-chlorophenyl)-2-phenylpyrazolo[1,5-a]pyrimidin-7-yl]methanone |
| Molecular Weight: | 552.03 |
| Molecular Formula: | C31 H26 Cl N5 O3 |
| Salt: | not_available |
| Smiles: | C1CN(CCN1Cc1ccc2c(c1)OCO2)C(c1cc(c2ccccc2[Cl])nc2cc(c3ccccc3)nn12)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6462 |
| logD: | 5.4541 |
| logSw: | -5.8321 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 55.43 |
| InChI Key: | STMVZHUZXRKKAR-UHFFFAOYSA-N |