{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}[1-(3-fluorophenyl)-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methanone
Chemical Structure Depiction of
{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}[1-(3-fluorophenyl)-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methanone
{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}[1-(3-fluorophenyl)-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methanone
Compound characteristics
| Compound ID: | G013-0538 |
| Compound Name: | {4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}[1-(3-fluorophenyl)-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methanone |
| Molecular Weight: | 473.51 |
| Molecular Formula: | C26 H24 F N5 O3 |
| Smiles: | C1CN(CCN1Cc1ccc2c(c1)OCO2)C(c1cnn(c2cccc(c2)F)c1n1cccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9804 |
| logD: | 3.7888 |
| logSw: | -4.0083 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 54.399 |
| InChI Key: | PZVDSIULQCTTQV-UHFFFAOYSA-N |