methyl 4-{4-[3-(2,4-dichlorophenyl)-1H-pyrazol-5-yl]benzamido}butanoate
Chemical Structure Depiction of
methyl 4-{4-[3-(2,4-dichlorophenyl)-1H-pyrazol-5-yl]benzamido}butanoate
methyl 4-{4-[3-(2,4-dichlorophenyl)-1H-pyrazol-5-yl]benzamido}butanoate
Compound characteristics
| Compound ID: | V002-8809 |
| Compound Name: | methyl 4-{4-[3-(2,4-dichlorophenyl)-1H-pyrazol-5-yl]benzamido}butanoate |
| Molecular Weight: | 432.3 |
| Molecular Formula: | C21 H19 Cl2 N3 O3 |
| Salt: | not_available |
| Smiles: | COC(CCCNC(c1ccc(cc1)c1cc(c2ccc(cc2[Cl])[Cl])n[nH]1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3891 |
| logD: | 4.3891 |
| logSw: | -4.634 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.562 |
| InChI Key: | SBSDYHCJIZMEIS-UHFFFAOYSA-N |