[3-(3,4-dimethylphenyl)-1H-pyrazol-5-yl]{4-[(1-ethyl-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-yl)methyl]piperazin-1-yl}methanone
Chemical Structure Depiction of
[3-(3,4-dimethylphenyl)-1H-pyrazol-5-yl]{4-[(1-ethyl-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-yl)methyl]piperazin-1-yl}methanone
[3-(3,4-dimethylphenyl)-1H-pyrazol-5-yl]{4-[(1-ethyl-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-yl)methyl]piperazin-1-yl}methanone
Compound characteristics
| Compound ID: | SC19-0548 |
| Compound Name: | [3-(3,4-dimethylphenyl)-1H-pyrazol-5-yl]{4-[(1-ethyl-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-yl)methyl]piperazin-1-yl}methanone |
| Molecular Weight: | 448.57 |
| Molecular Formula: | C25 H32 N6 O2 |
| Smiles: | CCn1c2CCOCc2c(CN2CCN(CC2)C(c2cc(c3ccc(C)c(C)c3)n[nH]2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.6719 |
| logD: | 0.0502 |
| logSw: | -2.7593 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.196 |
| InChI Key: | SRFIOWZPHYKGJM-UHFFFAOYSA-N |