![2-[(3-Bromophenyl)methylideneamino]guanidine structure](/static/products/7211/72116-12-2.webp)
2-[(3-Bromophenyl)methylideneamino]guanidine
TL;DR: 2-[(3-Bromophenyl)methylideneamino]guanidine (CAS 72116-12-2) is a chemical compound with molecular formula C8H9BrN4 and molecular weight 240.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3-bromophenyl)methylideneamino]guanidine
Also Known As: NCIOpen2_003413, 2-[(3-bromophenyl)methylideneamino]guanidine, 2-[(E)-(3-bromophenyl)methylideneamino]guanidine
| Molecular Formula | C8H9BrN4 |
|---|---|
| Molecular Weight | 240.00 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 76.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 240.00105 |
| Heavy Atoms | 13 |
| Complexity | 210.0 |
Chemical Identifiers
| CAS Number | 72116-12-2 |
|---|---|
| SMILES | C1=CC(=CC(=C1)Br)C=NN=C(N)N |
| InChIKey | HDBMYFNAHBEHSA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-[(3-Bromophenyl)methylideneamino]guanidine (CAS 72116-12-2), with molecular formula C8H9BrN4 and molecular weight 240.00 g/mol. IUPAC: 2-[(3-bromophenyl)methylideneamino]guanidine.
Chemical Property Profile of 2-[(3-Bromophenyl)methylideneamino]guanidine
Property Insights of 2-[(3-Bromophenyl)methylideneamino]guanidine
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(3-Bromophenyl)methylideneamino]guanidine. The TPSA of 76.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(3-Bromophenyl)methylideneamino]guanidine. Following Lipinski's Rule of Five, 2-[(3-Bromophenyl)methylideneamino]guanidine has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-[(3-Bromophenyl)methylideneamino]guanidine?
The CAS number of 2-[(3-Bromophenyl)methylideneamino]guanidine is 72116-12-2.
What is the molecular formula of 2-[(3-Bromophenyl)methylideneamino]guanidine?
The molecular formula of 2-[(3-Bromophenyl)methylideneamino]guanidine is C8H9BrN4.
What is the molecular weight of 2-[(3-Bromophenyl)methylideneamino]guanidine?
The molecular weight of 2-[(3-Bromophenyl)methylideneamino]guanidine is 240.00 g/mol.
Where can I buy 2-[(3-Bromophenyl)methylideneamino]guanidine?
You can request a quote for 2-[(3-Bromophenyl)methylideneamino]guanidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(3-Bromophenyl)methylideneamino]guanidine?
Yes, KEHONG BIO provides custom synthesis services for 2-[(3-Bromophenyl)methylideneamino]guanidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.