5-Aminobenzene-1,3-dicarboxamide
TL;DR: 5-Aminobenzene-1,3-dicarboxamide (CAS 28321-49-5) is a chemical compound with molecular formula C8H9N3O2 and molecular weight 179.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-aminobenzene-1,3-dicarboxamide
Also Known As: 5-Amino-isophthalamide, 5-Aminoisophthalamide, 5-aminobenzene-1,3-dicarboxamide, 5-amino-1,3-Benzenedicarboxamide, IFLab1_000079
| Molecular Formula | C8H9N3O2 |
|---|---|
| Molecular Weight | 179.07 g/mol |
| LogP | -0.5334 |
| Topological Polar Surface Area | 112.2 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 179.06947 |
| Heavy Atoms | 13 |
| Complexity | 341.40192 |
Chemical Identifiers
| CAS Number | 28321-49-5 |
|---|---|
| SMILES | C1=C(C=C(C=C1C(=O)N)N)C(=O)N |
Product Overview
5-Aminobenzene-1,3-dicarboxamide (CAS 28321-49-5), with molecular formula C8H9N3O2 and molecular weight 179.07 g/mol. IUPAC: 5-aminobenzene-1,3-dicarboxamide.
Chemical Property Profile of 5-Aminobenzene-1,3-dicarboxamide
Property Insights of 5-Aminobenzene-1,3-dicarboxamide
The XLogP value of -0.5334 indicates that 5-Aminobenzene-1,3-dicarboxamide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 112.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Aminobenzene-1,3-dicarboxamide. Following Lipinski's Rule of Five, 5-Aminobenzene-1,3-dicarboxamide has 3 hydrogen bond donor(s) and 3 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 5-Aminobenzene-1,3-dicarboxamide?
The CAS number of 5-Aminobenzene-1,3-dicarboxamide is 28321-49-5.
What is the molecular formula of 5-Aminobenzene-1,3-dicarboxamide?
The molecular formula of 5-Aminobenzene-1,3-dicarboxamide is C8H9N3O2.
What is the molecular weight of 5-Aminobenzene-1,3-dicarboxamide?
The molecular weight of 5-Aminobenzene-1,3-dicarboxamide is 179.07 g/mol.
Where can I buy 5-Aminobenzene-1,3-dicarboxamide?
You can request a quote for 5-Aminobenzene-1,3-dicarboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Aminobenzene-1,3-dicarboxamide?
Yes, KEHONG BIO provides custom synthesis services for 5-Aminobenzene-1,3-dicarboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.