{4-[3-(3,5-dimethyl-1H-pyrazol-1-yl)-4-nitrophenyl]piperazin-1-yl}(4-propoxyphenyl)methanone
Chemical Structure Depiction of
{4-[3-(3,5-dimethyl-1H-pyrazol-1-yl)-4-nitrophenyl]piperazin-1-yl}(4-propoxyphenyl)methanone
{4-[3-(3,5-dimethyl-1H-pyrazol-1-yl)-4-nitrophenyl]piperazin-1-yl}(4-propoxyphenyl)methanone
Compound characteristics
| Compound ID: | 8017-0145 |
| Compound Name: | {4-[3-(3,5-dimethyl-1H-pyrazol-1-yl)-4-nitrophenyl]piperazin-1-yl}(4-propoxyphenyl)methanone |
| Molecular Weight: | 463.54 |
| Molecular Formula: | C25 H29 N5 O4 |
| Smiles: | CCCOc1ccc(cc1)C(N1CCN(CC1)c1ccc(c(c1)n1c(C)cc(C)n1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.628 |
| logD: | 3.628 |
| logSw: | -3.7967 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 74.216 |
| InChI Key: | BWNJMMPNOBZBMA-UHFFFAOYSA-N |