Benzoic acid, 3,5-dibromo-4-((dicyanomethylene)hydrazino)-
TL;DR: Benzoic acid, 3,5-dibromo-4-((dicyanomethylene)hydrazino)- (CAS 64692-00-8) is a chemical compound with molecular formula C11H6Br2N4O2 and molecular weight 383.89 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3,5-dibromo-4-[2-(dicyanomethylidene)hydrazinyl]benzoate
Also Known As: Benzoic acid, 3,5-dibromo-4-((dicyanomethylene)hydrazino)-, 3,5-Dibromo-4-((dicyanomethylene)hydrazino)benzoic acid, methyl 3,5-dibromo-4-[2-(dicyanomethylidene)hydrazinyl]benzoate, 2-[2-[2-(2-pyridin-2-ylethylsulfanyl)ethylsulfanyl]ethyl]pyridine, Benzoic acid,3,5-dibromo-4-[2-(dicyanomethylene)hydrazinyl]-, methyl ester
| Molecular Formula | C11H6Br2N4O2 |
|---|---|
| Molecular Weight | 383.89 g/mol |
| LogP | 2.81326 |
| Topological Polar Surface Area | 98.27 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 383.88574 |
| Heavy Atoms | 19 |
| Complexity | 589.558 |
Chemical Identifiers
| CAS Number | 64692-00-8 |
|---|---|
| SMILES | COC(=O)C1=CC(=C(C(=C1)Br)NN=C(C#N)C#N)Br |
Product Overview
Benzoic acid, 3,5-dibromo-4-((dicyanomethylene)hydrazino)- (CAS 64692-00-8), with molecular formula C11H6Br2N4O2 and molecular weight 383.89 g/mol. IUPAC: methyl 3,5-dibromo-4-[2-(dicyanomethylidene)hydrazinyl]benzoate.
Chemical Property Profile of Benzoic acid, 3,5-dibromo-4-((dicyanomethylene)hydrazino)-
Property Insights of Benzoic acid, 3,5-dibromo-4-((dicyanomethylene)hydrazino)-
The XLogP value of 2.81326 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzoic acid, 3,5-dibromo-4-((dicyanomethylene)hydrazino)-. The TPSA of 98.27 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoic acid, 3,5-dibromo-4-((dicyanomethylene)hydrazino)-. Following Lipinski's Rule of Five, Benzoic acid, 3,5-dibromo-4-((dicyanomethylene)hydrazino)- has 1 hydrogen bond donor(s) and 6 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 Benzoic acid, 3,5-dibromo-4-((dicyanomethylene)hydrazino)-?
The CAS number of Benzoic acid, 3,5-dibromo-4-((dicyanomethylene)hydrazino)- is 64692-00-8.
What is the molecular formula of Benzoic acid, 3,5-dibromo-4-((dicyanomethylene)hydrazino)-?
The molecular formula of Benzoic acid, 3,5-dibromo-4-((dicyanomethylene)hydrazino)- is C11H6Br2N4O2.
What is the molecular weight of Benzoic acid, 3,5-dibromo-4-((dicyanomethylene)hydrazino)-?
The molecular weight of Benzoic acid, 3,5-dibromo-4-((dicyanomethylene)hydrazino)- is 383.89 g/mol.
Where can I buy Benzoic acid, 3,5-dibromo-4-((dicyanomethylene)hydrazino)-?
You can request a quote for Benzoic acid, 3,5-dibromo-4-((dicyanomethylene)hydrazino)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 3,5-dibromo-4-((dicyanomethylene)hydrazino)-?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 3,5-dibromo-4-((dicyanomethylene)hydrazino)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.