HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 5481306Generated: November 3, 2026
N-[(Z)-1-pyrazin-2-ylethylideneamino]-3-azabicyclo[3.2.2]nonane-3-carbothioamide
https://huagongshe.com/en/chemical/5481306
Identifiers & Physical Properties
| CAS No. | 88324-52-1 |
|---|
| Molecular formula | C15H21N5S |
|---|
| Average molar mass | 303.4 g/mol |
|---|
| Monoisotopic mass | 303.15176686 g/mol |
|---|
| SMILES | C/C(=N/NC(=S)N1CC2CCC(CC2)C1)c1cnccn1 |
|---|
| InChIKey | HCNCHPUSRLRNJS-WQRHYEAKSA-N |
|---|
| PubChem CID | 5481306 |
|---|
| ChEMBL | CHEMBL1969496 |
|---|
Chemical & Physical Properties
| XLogP | 1.7 |
|---|
| Topological polar surface area | 85.5 |
|---|
| Hydrogen bond donors | 1 |
|---|
| Hydrogen bond acceptors | 4 |
|---|
| Rotatable bonds | 2 |
|---|
| Heavy atoms | 21 |
|---|
| Formal charge | 0 |
|---|
| Complexity | 389 |
|---|