methyl 3-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)carbamamido]benzoate
Chemical Structure Depiction of
methyl 3-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)carbamamido]benzoate
methyl 3-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)carbamamido]benzoate
Compound characteristics
| Compound ID: | C270-0809 |
| Compound Name: | methyl 3-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)carbamamido]benzoate |
| Molecular Weight: | 380.4 |
| Molecular Formula: | C20 H20 N4 O4 |
| Smiles: | CC1=C(C(N(c2ccccc2)N1C)=O)NC(Nc1cccc(c1)C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4046 |
| logD: | 2.3972 |
| logSw: | -3.0018 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.096 |
| InChI Key: | FQKUJCLAFSKVMB-UHFFFAOYSA-N |