methyl 5-amino-1-[4-(butylcarbamoyl)phenyl]-1H-pyrazole-4-carboxylate
Chemical Structure Depiction of
methyl 5-amino-1-[4-(butylcarbamoyl)phenyl]-1H-pyrazole-4-carboxylate
methyl 5-amino-1-[4-(butylcarbamoyl)phenyl]-1H-pyrazole-4-carboxylate
Compound characteristics
| Compound ID: | G892-1147 |
| Compound Name: | methyl 5-amino-1-[4-(butylcarbamoyl)phenyl]-1H-pyrazole-4-carboxylate |
| Molecular Weight: | 316.36 |
| Molecular Formula: | C16 H20 N4 O3 |
| Smiles: | CCCCNC(c1ccc(cc1)n1c(c(cn1)C(=O)OC)N)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0831 |
| logD: | 2.0831 |
| logSw: | -2.8573 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 79.255 |
| InChI Key: | NIQUNYIZFAMJTG-UHFFFAOYSA-N |