C11H11ClFN3S — CID 103053663
[2-(5-chloro-2-fluorophenyl)-1-(1,3-thiazol-5-yl)ethyl]hydrazine (PubChem CID 103053663) has the molecular formula C11H11ClFN3S and a molecular weight of 271.75 g/mol. Its IUPAC name is [2-(5-chloro-2-fluorophenyl)-1-(1,3-thiazol-5-yl)ethyl]hydrazine.
| Compound Name | [2-(5-chloro-2-fluorophenyl)-1-(1,3-thiazol-5-yl)ethyl]hydrazine |
|---|---|
| PubChem CID | 103053663 |
| Molecular Formula | C11H11ClFN3S |
| Molecular Weight | 271.75 g/mol |
| Exact Mass | 271.03 |
| IUPAC Name | [2-(5-chloro-2-fluorophenyl)-1-(1,3-thiazol-5-yl)ethyl]hydrazine |
| SMILES | NNC(Cc1cc(Cl)ccc1F)c1cncs1 |
| InChI | InChI=1S/C11H11ClFN3S/c12-8-1-2-9(13)7(3-8)4-10(16-14)11-5-15-6-17-11/h1-3,5-6,10,16H,4,14H2 |
| InChIKey | YBNWJHMFKWNOEM-UHFFFAOYSA-N |
| XLogP | 2.68 |
| TPSA | 50.94 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 17 |
| Complexity | — |
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 271.75 |
| LogP ≤ 5 | 2.68 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 4 |
| Structural Alerts | {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'} |
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