methyl 3-{[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl](methyl)carbamamido}benzoate
Chemical Structure Depiction of
methyl 3-{[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl](methyl)carbamamido}benzoate
methyl 3-{[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl](methyl)carbamamido}benzoate
Compound characteristics
| Compound ID: | G531-0327 |
| Compound Name: | methyl 3-{[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl](methyl)carbamamido}benzoate |
| Molecular Weight: | 358.44 |
| Molecular Formula: | C19 H26 N4 O3 |
| Smiles: | CCn1c(C)c(CCN(C)C(Nc2cccc(c2)C(=O)OC)=O)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.7129 |
| logD: | 2.7124 |
| logSw: | -3.0741 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.64 |
| InChI Key: | VRTACBXCNSOLGZ-UHFFFAOYSA-N |