About [(4-bromothiophen-3-yl)-(3-chloro-2-pyridinyl)methyl]hydrazine
[(4-bromothiophen-3-yl)-(3-chloro-2-pyridinyl)methyl]hydrazine (PubChem CID 103445884) has the molecular formula C10H9BrClN3S
and a molecular weight of 318.63 g/mol. Its IUPAC name is [(4-bromothiophen-3-yl)-(3-chloro-2-pyridinyl)methyl]hydrazine.
Molecular Properties
| Compound Name | [(4-bromothiophen-3-yl)-(3-chloro-2-pyridinyl)methyl]hydrazine |
| PubChem CID | 103445884 |
| Molecular Formula | C10H9BrClN3S |
| Molecular Weight | 318.63 g/mol |
| Exact Mass | 316.94 |
| IUPAC Name | [(4-bromothiophen-3-yl)-(3-chloro-2-pyridinyl)methyl]hydrazine |
| SMILES | NNC(c1cscc1Br)c1ncccc1Cl |
| InChI | InChI=1S/C10H9BrClN3S/c11-7-5-16-4-6(7)9(15-13)10-8(12)2-1-3-14-10/h1-5,9,15H,13H2 |
| InChIKey | LXCZHZBLIPZRQJ-UHFFFAOYSA-N |
| XLogP | 3.11 |
| TPSA | 50.94 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 318.63 |
| LogP ≤ 5 | 3.11 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 4 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'} |
|---|
Analyze [(4-bromothiophen-3-yl)-(3-chloro-2-pyridinyl)methyl]hydrazine with MolForge
Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.
Launch Full Analysis
Frequently Asked Questions
What is the IUPAC name of [(4-bromothiophen-3-yl)-(3-chloro-2-pyridinyl)methyl]hydrazine?
The IUPAC name of [(4-bromothiophen-3-yl)-(3-chloro-2-pyridinyl)methyl]hydrazine (CID 103445884) is [(4-bromothiophen-3-yl)-(3-chloro-2-pyridinyl)methyl]hydrazine.
What is the SMILES notation for [(4-bromothiophen-3-yl)-(3-chloro-2-pyridinyl)methyl]hydrazine?
The canonical SMILES for [(4-bromothiophen-3-yl)-(3-chloro-2-pyridinyl)methyl]hydrazine is NNC(c1cscc1Br)c1ncccc1Cl.
What is the InChIKey of [(4-bromothiophen-3-yl)-(3-chloro-2-pyridinyl)methyl]hydrazine?
The InChIKey is LXCZHZBLIPZRQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9BrClN3S/c11-7-5-16-4-6(7)9(15-13)10-8(12)2-1-3-14-10/h1-5,9,15H,13H2.
What are the key properties of [(4-bromothiophen-3-yl)-(3-chloro-2-pyridinyl)methyl]hydrazine?
[(4-bromothiophen-3-yl)-(3-chloro-2-pyridinyl)methyl]hydrazine has a molecular weight of 318.63 g/mol, XLogP of 3.11, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(4-bromothiophen-3-yl)-(3-chloro-2-pyridinyl)methyl]hydrazine is sourced from PubChem (CID 103445884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).