3-{4-[(1,3-dimethyl-1H-pyrazol-4-yl)methyl]piperazine-1-carbonyl}bicyclo[2.2.1]hept-5-ene-2-carboxylic acid
Chemical Structure Depiction of
3-{4-[(1,3-dimethyl-1H-pyrazol-4-yl)methyl]piperazine-1-carbonyl}bicyclo[2.2.1]hept-5-ene-2-carboxylic acid
3-{4-[(1,3-dimethyl-1H-pyrazol-4-yl)methyl]piperazine-1-carbonyl}bicyclo[2.2.1]hept-5-ene-2-carboxylic acid
Compound characteristics
| Compound ID: | Y504-7872 |
| Compound Name: | 3-{4-[(1,3-dimethyl-1H-pyrazol-4-yl)methyl]piperazine-1-carbonyl}bicyclo[2.2.1]hept-5-ene-2-carboxylic acid |
| Molecular Weight: | 358.44 |
| Molecular Formula: | C19 H26 N4 O3 |
| Smiles: | Cc1c(CN2CCN(CC2)C(C2C3CC(C=C3)C2C(O)=O)=O)cn(C)n1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 0.2141 |
| logD: | 0.2141 |
| logSw: | -0.5597 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.842 |
| InChI Key: | MZTPUDTWMWKCCL-UHFFFAOYSA-N |