3-Pyridinol, 2,5-dimethyl-4-mercaptomethyl-
TL;DR: 3-Pyridinol, 2,5-dimethyl-4-mercaptomethyl- (CAS 78232-27-6) is a chemical compound with molecular formula C8H11NOS and molecular weight 169.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5-dimethyl-4-(sulfanylmethyl)pyridin-3-ol
Also Known As: 4-Mercapto-5-desoxypyridoxin, 3-Pyridinol, 2,5-dimethyl-4-mercaptomethyl-, 4-Mercapto-5-desoxypyridoxin [German], 2,5-Dimethyl-4-mercaptomethyl-3-pyridinol, 2,5-dimethyl-4-(sulfanylmethyl)pyridin-3-ol
| Molecular Formula | C8H11NOS |
|---|---|
| Molecular Weight | 169.06 g/mol |
| LogP | 1.83384 |
| Topological Polar Surface Area | 33.12 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 169.05614 |
| Heavy Atoms | 11 |
| Complexity | 273.03973 |
Chemical Identifiers
| CAS Number | 78232-27-6 |
|---|---|
| SMILES | CC1=CN=C(C(=C1CS)O)C |
Product Overview
3-Pyridinol, 2,5-dimethyl-4-mercaptomethyl- (CAS 78232-27-6), with molecular formula C8H11NOS and molecular weight 169.06 g/mol. IUPAC: 2,5-dimethyl-4-(sulfanylmethyl)pyridin-3-ol.
Chemical Property Profile of 3-Pyridinol, 2,5-dimethyl-4-mercaptomethyl-
Property Insights of 3-Pyridinol, 2,5-dimethyl-4-mercaptomethyl-
The XLogP value of 1.83384 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Pyridinol, 2,5-dimethyl-4-mercaptomethyl-. With a topological polar surface area (TPSA) of 33.12 Ų, 3-Pyridinol, 2,5-dimethyl-4-mercaptomethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Pyridinol, 2,5-dimethyl-4-mercaptomethyl- has 2 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 3-Pyridinol, 2,5-dimethyl-4-mercaptomethyl-?
The CAS number of 3-Pyridinol, 2,5-dimethyl-4-mercaptomethyl- is 78232-27-6.
What is the molecular formula of 3-Pyridinol, 2,5-dimethyl-4-mercaptomethyl-?
The molecular formula of 3-Pyridinol, 2,5-dimethyl-4-mercaptomethyl- is C8H11NOS.
What is the molecular weight of 3-Pyridinol, 2,5-dimethyl-4-mercaptomethyl-?
The molecular weight of 3-Pyridinol, 2,5-dimethyl-4-mercaptomethyl- is 169.06 g/mol.
Where can I buy 3-Pyridinol, 2,5-dimethyl-4-mercaptomethyl-?
You can request a quote for 3-Pyridinol, 2,5-dimethyl-4-mercaptomethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Pyridinol, 2,5-dimethyl-4-mercaptomethyl-?
Yes, KEHONG BIO provides custom synthesis services for 3-Pyridinol, 2,5-dimethyl-4-mercaptomethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.