![4-[(2-amino-4-sulfanylidene-1H-pteridin-6-yl)methyl-methylamino]benzoic acid structure](/static/products/5147/51471-54-6.webp)
4-[(2-amino-4-sulfanylidene-1H-pteridin-6-yl)methyl-methylamino]benzoic acid
TL;DR: 4-[(2-amino-4-sulfanylidene-1H-pteridin-6-yl)methyl-methylamino]benzoic acid (CAS 51471-54-6) is a chemical compound with molecular formula C15H14N6O2S and molecular weight 342.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(2-amino-4-sulfanylidene-1H-pteridin-6-yl)methyl-methylamino]benzoic acid
Also Known As: 4-[(2-amino-4-sulfanylidene-1H-pteridin-6-yl)methyl-methylam, 4-[(2-amino-4-sulfanylidene-1H-pteridin-6-yl)methyl-methylamino]benzoic acid, 4-{[(2-Amino-4-sulfanylidene-1,4-dihydropteridin-6-yl)methyl](methyl)amino}benzoic acid
| Molecular Formula | C15H14N6O2S |
|---|---|
| Molecular Weight | 342.09 g/mol |
| LogP | 1.99919 |
| Topological Polar Surface Area | 121.02 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 342.0899 |
| Heavy Atoms | 24 |
| Complexity | 969.85535 |
Chemical Identifiers
| CAS Number | 51471-54-6 |
|---|---|
| SMILES | CN(CC1=CN=C2C(=N1)C(=S)N=C(N2)N)C3=CC=C(C=C3)C(=O)O |
Product Overview
4-[(2-amino-4-sulfanylidene-1H-pteridin-6-yl)methyl-methylamino]benzoic acid (CAS 51471-54-6), with molecular formula C15H14N6O2S and molecular weight 342.09 g/mol. IUPAC: 4-[(2-amino-4-sulfanylidene-1H-pteridin-6-yl)methyl-methylamino]benzoic acid.
Chemical Property Profile of 4-[(2-amino-4-sulfanylidene-1H-pteridin-6-yl)methyl-methylamino]benzoic acid
Property Insights of 4-[(2-amino-4-sulfanylidene-1H-pteridin-6-yl)methyl-methylamino]benzoic acid
The XLogP value of 1.99919 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[(2-amino-4-sulfanylidene-1H-pteridin-6-yl)methyl-methylamino]benzoic acid. The TPSA of 121.02 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[(2-amino-4-sulfanylidene-1H-pteridin-6-yl)methyl-methylamino]benzoic acid. Following Lipinski's Rule of Five, 4-[(2-amino-4-sulfanylidene-1H-pteridin-6-yl)methyl-methylamino]benzoic acid has 3 hydrogen bond donor(s) and 7 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 4-[(2-amino-4-sulfanylidene-1H-pteridin-6-yl)methyl-methylamino]benzoic acid?
The CAS number of 4-[(2-amino-4-sulfanylidene-1H-pteridin-6-yl)methyl-methylamino]benzoic acid is 51471-54-6.
What is the molecular formula of 4-[(2-amino-4-sulfanylidene-1H-pteridin-6-yl)methyl-methylamino]benzoic acid?
The molecular formula of 4-[(2-amino-4-sulfanylidene-1H-pteridin-6-yl)methyl-methylamino]benzoic acid is C15H14N6O2S.
What is the molecular weight of 4-[(2-amino-4-sulfanylidene-1H-pteridin-6-yl)methyl-methylamino]benzoic acid?
The molecular weight of 4-[(2-amino-4-sulfanylidene-1H-pteridin-6-yl)methyl-methylamino]benzoic acid is 342.09 g/mol.
Where can I buy 4-[(2-amino-4-sulfanylidene-1H-pteridin-6-yl)methyl-methylamino]benzoic acid?
You can request a quote for 4-[(2-amino-4-sulfanylidene-1H-pteridin-6-yl)methyl-methylamino]benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(2-amino-4-sulfanylidene-1H-pteridin-6-yl)methyl-methylamino]benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-[(2-amino-4-sulfanylidene-1H-pteridin-6-yl)methyl-methylamino]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.