HuagongsheHuagongshe Chemistry Print Report · For research reference only
Acetone, 4-(9-acridinyl)-2-methyl-3-thiosemicarbazone
Identifiers & Physical Properties
| CAS No. | 29023-85-6 |
|---|---|
| Molecular formula | C18H18N4S |
| Average molar mass | 322.4 g/mol |
| Monoisotopic mass | 322.12521776 g/mol |
| SMILES | CC(C)=NN(C)C(=S)Nc1c2ccccc2nc2ccccc12 |
| InChIKey | OTYZLVRFJPWZQK-UHFFFAOYSA-N |
| PubChem CID | 3038136 |
| DTXSID | DTXSID00183266 |
Chemical & Physical Properties
| XLogP | 3.5 |
|---|---|
| Topological polar surface area | 72.6 |
| Hydrogen bond donors | 1 |
| Hydrogen bond acceptors | 3 |
| Rotatable bonds | 2 |
| Heavy atoms | 23 |
| Formal charge | 0 |
| Complexity | 438 |