间苯二甲酰胺酸
TL;DR: 间苯二甲酰胺酸 (CAS 4481-28-1) is a chemical compound with molecular formula C8H7NO3 and molecular weight 165.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
间苯二甲酰胺酸
3-carbamoylbenzoic acid
Also Known As: 3-carbamoylbenzoic acid, Isophthalamic acid, 3-(Aminocarbonyl)benzoic acid, 3-Carboxamidobenzoic acid, isophthalic amide
| Molecular Formula | C8H7NO3 |
|---|---|
| Molecular Weight | 165.04 g/mol |
| LogP | 0.4837 |
| Topological Polar Surface Area | 80.39 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 165.04259 |
| Heavy Atoms | 12 |
| Complexity | 303.57977 |
Chemical Identifiers
| CAS Number | 4481-28-1 |
|---|---|
| SMILES | C1=CC(=CC(=C1)C(=O)O)C(=O)N |
Product Overview
间苯二甲酰胺酸 (CAS 4481-28-1), with molecular formula C8H7NO3 and molecular weight 165.04 g/mol. IUPAC: 3-carbamoylbenzoic acid.
Chemical Property Profile of 间苯二甲酰胺酸
Property Insights of 间苯二甲酰胺酸
The XLogP value of 0.4837 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 间苯二甲酰胺酸. The TPSA of 80.39 Ų falls within the moderate polarity range, balancing permeability and solubility for 间苯二甲酰胺酸. Following Lipinski's Rule of Five, 间苯二甲酰胺酸 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 间苯二甲酰胺酸?
The CAS number of 间苯二甲酰胺酸 is 4481-28-1.
What is the molecular formula of 间苯二甲酰胺酸?
The molecular formula of 间苯二甲酰胺酸 is C8H7NO3.
What is the molecular weight of 间苯二甲酰胺酸?
The molecular weight of 间苯二甲酰胺酸 is 165.04 g/mol.
Where can I buy 间苯二甲酰胺酸?
You can request a quote for 间苯二甲酰胺酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 间苯二甲酰胺酸?
Yes, KEHONG BIO provides custom synthesis services for 间苯二甲酰胺酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.