ethyl 3-amino-1-(4-bromobenzoyl)-5-(4-methoxyphenyl)-1H-pyrazole-4-carboxylate
Chemical Structure Depiction of
ethyl 3-amino-1-(4-bromobenzoyl)-5-(4-methoxyphenyl)-1H-pyrazole-4-carboxylate
ethyl 3-amino-1-(4-bromobenzoyl)-5-(4-methoxyphenyl)-1H-pyrazole-4-carboxylate
Compound characteristics
| Compound ID: | 8017-1466 |
| Compound Name: | ethyl 3-amino-1-(4-bromobenzoyl)-5-(4-methoxyphenyl)-1H-pyrazole-4-carboxylate |
| Molecular Weight: | 444.28 |
| Molecular Formula: | C20 H18 Br N3 O4 |
| Smiles: | CCOC(c1c(N)nn(C(c2ccc(cc2)[Br])=O)c1c1ccc(cc1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.603 |
| logD: | 3.603 |
| logSw: | -3.7835 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.027 |
| InChI Key: | ZKKOBIIVVNEJSS-UHFFFAOYSA-N |