dimethyl 2-{[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl](methyl)carbamamido}benzene-1,4-dicarboxylate
Chemical Structure Depiction of
dimethyl 2-{[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl](methyl)carbamamido}benzene-1,4-dicarboxylate
dimethyl 2-{[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl](methyl)carbamamido}benzene-1,4-dicarboxylate
Compound characteristics
| Compound ID: | G531-0282 |
| Compound Name: | dimethyl 2-{[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl](methyl)carbamamido}benzene-1,4-dicarboxylate |
| Molecular Weight: | 416.48 |
| Molecular Formula: | C21 H28 N4 O5 |
| Smiles: | CCn1c(C)c(CCN(C)C(Nc2cc(ccc2C(=O)OC)C(=O)OC)=O)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.6525 |
| logD: | 2.6273 |
| logSw: | -3.0246 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.116 |
| InChI Key: | UBXZJKXCKOKWIE-UHFFFAOYSA-N |