ethyl 2-{[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]carbamamido}benzoate
Chemical Structure Depiction of
ethyl 2-{[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]carbamamido}benzoate
ethyl 2-{[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]carbamamido}benzoate
Compound characteristics
| Compound ID: | G531-0103 |
| Compound Name: | ethyl 2-{[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]carbamamido}benzoate |
| Molecular Weight: | 358.44 |
| Molecular Formula: | C19 H26 N4 O3 |
| Smiles: | CCn1c(C)c(CCNC(Nc2ccccc2C(=O)OCC)=O)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.5039 |
| logD: | 2.4994 |
| logSw: | -2.9019 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.039 |
| InChI Key: | XFWSEWCGLBMQIT-UHFFFAOYSA-N |