methyl 3-{[4-(ethoxycarbonyl)phenyl]carbamoyl}-1-methyl-1H-pyrazole-5-carboxylate
Chemical Structure Depiction of
methyl 3-{[4-(ethoxycarbonyl)phenyl]carbamoyl}-1-methyl-1H-pyrazole-5-carboxylate
methyl 3-{[4-(ethoxycarbonyl)phenyl]carbamoyl}-1-methyl-1H-pyrazole-5-carboxylate
Compound characteristics
| Compound ID: | 8018-0840 |
| Compound Name: | methyl 3-{[4-(ethoxycarbonyl)phenyl]carbamoyl}-1-methyl-1H-pyrazole-5-carboxylate |
| Molecular Weight: | 331.33 |
| Molecular Formula: | C16 H17 N3 O5 |
| Smiles: | CCOC(c1ccc(cc1)NC(c1cc(C(=O)OC)n(C)n1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9835 |
| logD: | 1.9817 |
| logSw: | -2.6583 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.773 |
| InChI Key: | ATGULFIEHAENGA-UHFFFAOYSA-N |