Lipoyl-4-aminobenzoic acid
TL;DR: Lipoyl-4-aminobenzoic acid (CAS 129706-46-3) is a chemical compound with molecular formula C15H19NO3S2 and molecular weight 325.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[5-[(3R)-dithiolan-3-yl]pentanoylamino]benzoic acid
Also Known As: Lipo-pab, L-Paba, Lipoyl-4-aminobenzoic acid, Lipoyl-p-aminobenzoate, N-Pentafluorophenylmethylene-benzene-1,2-diamine
| Molecular Formula | C15H19NO3S2 |
|---|---|
| Molecular Weight | 325.08 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 117.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 325.08063 |
| Heavy Atoms | 21 |
| Complexity | 357.0 |
Chemical Identifiers
| CAS Number | 129706-46-3 |
|---|---|
| SMILES | C1CSS[C@@H]1CCCCC(=O)NC2=CC=C(C=C2)C(=O)O |
| InChIKey | NEBJBHGIXSLSNP-CYBMUJFWSA-N |
Product Overview
Lipoyl-4-aminobenzoic acid (CAS 129706-46-3), with molecular formula C15H19NO3S2 and molecular weight 325.08 g/mol. IUPAC: 4-[5-[(3R)-dithiolan-3-yl]pentanoylamino]benzoic acid.
Chemical Property Profile of Lipoyl-4-aminobenzoic acid
Property Insights of Lipoyl-4-aminobenzoic acid
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Lipoyl-4-aminobenzoic acid. The TPSA of 117.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Lipoyl-4-aminobenzoic acid. Following Lipinski's Rule of Five, Lipoyl-4-aminobenzoic acid has 2 hydrogen bond donor(s) and 5 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 Lipoyl-4-aminobenzoic acid?
The CAS number of Lipoyl-4-aminobenzoic acid is 129706-46-3.
What is the molecular formula of Lipoyl-4-aminobenzoic acid?
The molecular formula of Lipoyl-4-aminobenzoic acid is C15H19NO3S2.
What is the molecular weight of Lipoyl-4-aminobenzoic acid?
The molecular weight of Lipoyl-4-aminobenzoic acid is 325.08 g/mol.
Where can I buy Lipoyl-4-aminobenzoic acid?
You can request a quote for Lipoyl-4-aminobenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Lipoyl-4-aminobenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for Lipoyl-4-aminobenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.