methyl 3-{methyl[2-(1,3,5-trimethyl-1H-pyrazol-4-yl)ethyl]carbamamido}benzoate
Chemical Structure Depiction of
methyl 3-{methyl[2-(1,3,5-trimethyl-1H-pyrazol-4-yl)ethyl]carbamamido}benzoate
methyl 3-{methyl[2-(1,3,5-trimethyl-1H-pyrazol-4-yl)ethyl]carbamamido}benzoate
Compound characteristics
| Compound ID: | G531-0242 |
| Compound Name: | methyl 3-{methyl[2-(1,3,5-trimethyl-1H-pyrazol-4-yl)ethyl]carbamamido}benzoate |
| Molecular Weight: | 344.41 |
| Molecular Formula: | C18 H24 N4 O3 |
| Smiles: | Cc1c(CCN(C)C(Nc2cccc(c2)C(=O)OC)=O)c(C)n(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.1742 |
| logD: | 2.1739 |
| logSw: | -2.9217 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.201 |
| InChI Key: | NSAQWJZAJWMDCU-UHFFFAOYSA-N |