C11H13BrN2OS2 — CID 105299660
[2-(3-bromothiophen-2-yl)-1-(4-methoxythiophen-2-yl)ethyl]hydrazine (PubChem CID 105299660) has the molecular formula C11H13BrN2OS2 and a molecular weight of 333.28 g/mol. Its IUPAC name is [2-(3-bromothiophen-2-yl)-1-(4-methoxythiophen-2-yl)ethyl]hydrazine.
| Compound Name | [2-(3-bromothiophen-2-yl)-1-(4-methoxythiophen-2-yl)ethyl]hydrazine |
|---|---|
| PubChem CID | 105299660 |
| Molecular Formula | C11H13BrN2OS2 |
| Molecular Weight | 333.28 g/mol |
| Exact Mass | 331.97 |
| IUPAC Name | [2-(3-bromothiophen-2-yl)-1-(4-methoxythiophen-2-yl)ethyl]hydrazine |
| SMILES | COc1csc(C(Cc2sccc2Br)NN)c1 |
| InChI | InChI=1S/C11H13BrN2OS2/c1-15-7-4-11(17-6-7)9(14-13)5-10-8(12)2-3-16-10/h2-4,6,9,14H,5,13H2,1H3 |
| InChIKey | JWLKJKBYVORETF-UHFFFAOYSA-N |
| XLogP | 3.33 |
| TPSA | 47.28 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 17 |
| Complexity | — |
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 333.28 |
| LogP ≤ 5 | 3.33 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 5 |
| Structural Alerts | {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'} |
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