HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 71557504Generated: October 29, 2026
7-(3,5-Difluorophenyl)-3-(3-methoxy-4-(4-methyl-1H-imidazol-1-yl)phenyl)-4,5,6,7-tetrahydrobenzo[d]isoxazole
https://huagongshe.com/en/chemical/71557504
Identifiers & Physical Properties
| Molecular formula | C24H21F2N3O2 |
|---|
| Average molar mass | 421.4 g/mol |
|---|
| Monoisotopic mass | 421.16018325 g/mol |
|---|
| SMILES | COc1cc(-c2noc3c2CCCC3c2cc(F)cc(F)c2)ccc1-n1cnc(C)c1 |
|---|
| InChIKey | JDPZQGFLGSDMGW-UHFFFAOYSA-N |
|---|
| PubChem CID | 71557504 |
|---|
| ChEMBL | CHEMBL4172191 |
|---|
Chemical & Physical Properties
| XLogP | 5 |
|---|
| Topological polar surface area | 53.1 |
|---|
| Hydrogen bond donors | 0 |
|---|
| Hydrogen bond acceptors | 6 |
|---|
| Rotatable bonds | 4 |
|---|
| Heavy atoms | 31 |
|---|
| Formal charge | 0 |
|---|
| Complexity | 603 |
|---|
![7-(3,5-Difluorophenyl)-3-(3-methoxy-4-(4-methyl-1H-imidazol-1-yl)phenyl)-4,5,6,7-tetrahydrobenzo[d]isoxazole molecular structure](/img/chemical/71557504.png)