3,5-Dibromo-4-hydroxy-benzamidine
TL;DR: 3,5-Dibromo-4-hydroxy-benzamidine (CAS 84436-15-7) is a chemical compound with molecular formula C23H21N5O6 and molecular weight 463.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-benzoyl-4-carbamimidoylphenyl) 4-(diaminomethylideneamino)benzoate;carbonic acid
Also Known As: 3,5-Dibromo-4-hydroxy-benzamidine, 4-Amidino-2-benzoylphenyl 4-guanidinobenzoate carbonate, Benzoicacid,4-( -,4- -2-benzoylphenylester,carbonate, Benzoic acid, 4-((aminoiminomethyl)amino)-, 4-(aminoiminomethyl)-2-benzoylphenyl ester, carbonate (1:1), Benzoic acid, 4-((aminoiminomethyl)amino)-, 4-(aminoiminomet
| Molecular Formula | C23H21N5O6 |
|---|---|
| Molecular Weight | 463.15 g/mol |
| LogP | 2.54817 |
| Topological Polar Surface Area | 215.17 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 463.14917 |
| Heavy Atoms | 34 |
| Complexity | 1232.4653 |
Chemical Identifiers
| CAS Number | 84436-15-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)C2=C(C=CC(=C2)C(=N)N)OC(=O)C3=CC=C(C=C3)N=C(N)N.C(=O)(O)O |
Product Overview
3,5-Dibromo-4-hydroxy-benzamidine (CAS 84436-15-7), with molecular formula C23H21N5O6 and molecular weight 463.15 g/mol. IUPAC: (2-benzoyl-4-carbamimidoylphenyl) 4-(diaminomethylideneamino)benzoate;carbonic acid.
Chemical Property Profile of 3,5-Dibromo-4-hydroxy-benzamidine
Property Insights of 3,5-Dibromo-4-hydroxy-benzamidine
The XLogP value of 2.54817 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,5-Dibromo-4-hydroxy-benzamidine. The TPSA of 215.17 Ų indicates high polarity, suggesting 3,5-Dibromo-4-hydroxy-benzamidine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3,5-Dibromo-4-hydroxy-benzamidine has 6 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3,5-Dibromo-4-hydroxy-benzamidine?
The CAS number of 3,5-Dibromo-4-hydroxy-benzamidine is 84436-15-7.
What is the molecular formula of 3,5-Dibromo-4-hydroxy-benzamidine?
The molecular formula of 3,5-Dibromo-4-hydroxy-benzamidine is C23H21N5O6.
What is the molecular weight of 3,5-Dibromo-4-hydroxy-benzamidine?
The molecular weight of 3,5-Dibromo-4-hydroxy-benzamidine is 463.15 g/mol.
Where can I buy 3,5-Dibromo-4-hydroxy-benzamidine?
You can request a quote for 3,5-Dibromo-4-hydroxy-benzamidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-Dibromo-4-hydroxy-benzamidine?
Yes, KEHONG BIO provides custom synthesis services for 3,5-Dibromo-4-hydroxy-benzamidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.