C11H11ClN4S2 — CID 105328693
[1-(3-chlorothiophen-2-yl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethyl]hydrazine (PubChem CID 105328693) has the molecular formula C11H11ClN4S2 and a molecular weight of 298.82 g/mol. Its IUPAC name is [1-(3-chlorothiophen-2-yl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethyl]hydrazine.
| Compound Name | [1-(3-chlorothiophen-2-yl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethyl]hydrazine |
|---|---|
| PubChem CID | 105328693 |
| Molecular Formula | C11H11ClN4S2 |
| Molecular Weight | 298.82 g/mol |
| Exact Mass | 298.01 |
| IUPAC Name | [1-(3-chlorothiophen-2-yl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethyl]hydrazine |
| SMILES | NNC(Cc1cn2ccsc2n1)c1sccc1Cl |
| InChI | InChI=1S/C11H11ClN4S2/c12-8-1-3-17-10(8)9(15-13)5-7-6-16-2-4-18-11(16)14-7/h1-4,6,9,15H,5,13H2 |
| InChIKey | PFNKEEDVAYCAAJ-UHFFFAOYSA-N |
| XLogP | 2.86 |
| TPSA | 55.35 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 18 |
| Complexity | — |
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 298.82 |
| LogP ≤ 5 | 2.86 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 6 |
| Structural Alerts | {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'} |
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