ethyl 4-[(2-{[3-methyl-1-(4-methylphenyl)-4-phenyl-1H-pyrazol-5-yl]amino}-2-oxoethyl)(propan-2-yl)carbamamido]benzoate
Chemical Structure Depiction of
ethyl 4-[(2-{[3-methyl-1-(4-methylphenyl)-4-phenyl-1H-pyrazol-5-yl]amino}-2-oxoethyl)(propan-2-yl)carbamamido]benzoate
ethyl 4-[(2-{[3-methyl-1-(4-methylphenyl)-4-phenyl-1H-pyrazol-5-yl]amino}-2-oxoethyl)(propan-2-yl)carbamamido]benzoate
Compound characteristics
| Compound ID: | V003-2386 |
| Compound Name: | ethyl 4-[(2-{[3-methyl-1-(4-methylphenyl)-4-phenyl-1H-pyrazol-5-yl]amino}-2-oxoethyl)(propan-2-yl)carbamamido]benzoate |
| Molecular Weight: | 553.66 |
| Molecular Formula: | C32 H35 N5 O4 |
| Smiles: | CCOC(c1ccc(cc1)NC(N(CC(Nc1c(c2ccccc2)c(C)nn1c1ccc(C)cc1)=O)C(C)C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.1418 |
| logD: | 6.1418 |
| logSw: | -5.6746 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.735 |
| InChI Key: | JLGGKCPNWBZHRK-UHFFFAOYSA-N |