methyl 5-amino-1-{4-[4-(3-chlorophenyl)piperazine-1-carbonyl]phenyl}-1H-pyrazole-4-carboxylate
Chemical Structure Depiction of
methyl 5-amino-1-{4-[4-(3-chlorophenyl)piperazine-1-carbonyl]phenyl}-1H-pyrazole-4-carboxylate
methyl 5-amino-1-{4-[4-(3-chlorophenyl)piperazine-1-carbonyl]phenyl}-1H-pyrazole-4-carboxylate
Compound characteristics
| Compound ID: | G892-0958 |
| Compound Name: | methyl 5-amino-1-{4-[4-(3-chlorophenyl)piperazine-1-carbonyl]phenyl}-1H-pyrazole-4-carboxylate |
| Molecular Weight: | 439.9 |
| Molecular Formula: | C22 H22 Cl N5 O3 |
| Smiles: | COC(c1cnn(c2ccc(cc2)C(N2CCN(CC2)c2cccc(c2)[Cl])=O)c1N)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9046 |
| logD: | 2.9046 |
| logSw: | -3.509 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.637 |
| InChI Key: | XODOEQSMJDIMSQ-UHFFFAOYSA-N |