methyl 2-([(4-ethylphenyl)methyl]{[3-(4-methoxyphenyl)-1H-pyrazol-4-yl]methyl}carbamamido)benzoate
Chemical Structure Depiction of
methyl 2-([(4-ethylphenyl)methyl]{[3-(4-methoxyphenyl)-1H-pyrazol-4-yl]methyl}carbamamido)benzoate
methyl 2-([(4-ethylphenyl)methyl]{[3-(4-methoxyphenyl)-1H-pyrazol-4-yl]methyl}carbamamido)benzoate
Compound characteristics
| Compound ID: | E002-1660 |
| Compound Name: | methyl 2-([(4-ethylphenyl)methyl]{[3-(4-methoxyphenyl)-1H-pyrazol-4-yl]methyl}carbamamido)benzoate |
| Molecular Weight: | 498.58 |
| Molecular Formula: | C29 H30 N4 O4 |
| Smiles: | CCc1ccc(CN(Cc2c[nH]nc2c2ccc(cc2)OC)C(Nc2ccccc2C(=O)OC)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.7696 |
| logD: | 5.7693 |
| logSw: | -5.4928 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.209 |
| InChI Key: | KWIGYURJWSVYQE-UHFFFAOYSA-N |