Pyridine, 3-amino-5-aminomethyl-4-mercaptomethyl-2-methyl-
TL;DR: Pyridine, 3-amino-5-aminomethyl-4-mercaptomethyl-2-methyl- (CAS 78218-50-5) is a chemical compound with molecular formula C8H13N3S and molecular weight 183.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-amino-5-(aminomethyl)-2-methyl-4-pyridinyl]methanethiol
Also Known As: 3,5-Diamino-4-mercapto-pyridoxin, 3,5-Diamino-4-mercapto-pyridoxin [German], Pyridine, 3-amino-5-aminomethyl-4-mercaptomethyl-2-methyl-, 5-22-11-00462 (Beilstein Handbook Reference), [3-amino-5-(aminomethyl)-2-methylpyridin-4-yl]methanethiol
| Molecular Formula | C8H13N3S |
|---|---|
| Molecular Weight | 183.08 g/mol |
| LogP | 0.86072 |
| Topological Polar Surface Area | 64.93 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 183.08302 |
| Heavy Atoms | 12 |
| Complexity | 285.87662 |
Chemical Identifiers
| CAS Number | 78218-50-5 |
|---|---|
| SMILES | CC1=NC=C(C(=C1N)CS)CN |
Product Overview
Pyridine, 3-amino-5-aminomethyl-4-mercaptomethyl-2-methyl- (CAS 78218-50-5), with molecular formula C8H13N3S and molecular weight 183.08 g/mol. IUPAC: [3-amino-5-(aminomethyl)-2-methyl-4-pyridinyl]methanethiol.
Chemical Property Profile of Pyridine, 3-amino-5-aminomethyl-4-mercaptomethyl-2-methyl-
Property Insights of Pyridine, 3-amino-5-aminomethyl-4-mercaptomethyl-2-methyl-
The XLogP value of 0.86072 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyridine, 3-amino-5-aminomethyl-4-mercaptomethyl-2-methyl-. The TPSA of 64.93 Ų falls within the moderate polarity range, balancing permeability and solubility for Pyridine, 3-amino-5-aminomethyl-4-mercaptomethyl-2-methyl-. Following Lipinski's Rule of Five, Pyridine, 3-amino-5-aminomethyl-4-mercaptomethyl-2-methyl- has 3 hydrogen bond donor(s) and 4 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 Pyridine, 3-amino-5-aminomethyl-4-mercaptomethyl-2-methyl-?
The CAS number of Pyridine, 3-amino-5-aminomethyl-4-mercaptomethyl-2-methyl- is 78218-50-5.
What is the molecular formula of Pyridine, 3-amino-5-aminomethyl-4-mercaptomethyl-2-methyl-?
The molecular formula of Pyridine, 3-amino-5-aminomethyl-4-mercaptomethyl-2-methyl- is C8H13N3S.
What is the molecular weight of Pyridine, 3-amino-5-aminomethyl-4-mercaptomethyl-2-methyl-?
The molecular weight of Pyridine, 3-amino-5-aminomethyl-4-mercaptomethyl-2-methyl- is 183.08 g/mol.
Where can I buy Pyridine, 3-amino-5-aminomethyl-4-mercaptomethyl-2-methyl-?
You can request a quote for Pyridine, 3-amino-5-aminomethyl-4-mercaptomethyl-2-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyridine, 3-amino-5-aminomethyl-4-mercaptomethyl-2-methyl-?
Yes, KEHONG BIO provides custom synthesis services for Pyridine, 3-amino-5-aminomethyl-4-mercaptomethyl-2-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.