ethyl 4-[butyl(2-{[1-(4-methoxyphenyl)-3-methyl-4-phenyl-1H-pyrazol-5-yl]amino}-2-oxoethyl)carbamamido]benzoate
Chemical Structure Depiction of
ethyl 4-[butyl(2-{[1-(4-methoxyphenyl)-3-methyl-4-phenyl-1H-pyrazol-5-yl]amino}-2-oxoethyl)carbamamido]benzoate
ethyl 4-[butyl(2-{[1-(4-methoxyphenyl)-3-methyl-4-phenyl-1H-pyrazol-5-yl]amino}-2-oxoethyl)carbamamido]benzoate
Compound characteristics
| Compound ID: | V025-4286 |
| Compound Name: | ethyl 4-[butyl(2-{[1-(4-methoxyphenyl)-3-methyl-4-phenyl-1H-pyrazol-5-yl]amino}-2-oxoethyl)carbamamido]benzoate |
| Molecular Weight: | 583.69 |
| Molecular Formula: | C33 H37 N5 O5 |
| Salt: | not_available |
| Smiles: | CCCCN(CC(Nc1c(c2ccccc2)c(C)nn1c1ccc(cc1)OC)=O)C(Nc1ccc(cc1)C(=O)OCC)=O |
| Stereo: | ACHIRAL |
| logP: | 6.2246 |
| logD: | 6.2246 |
| logSw: | -5.5287 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 90.514 |
| InChI Key: | JZOZZKJLKWLNLY-UHFFFAOYSA-N |