3-Pyridinethiol, 2-((2,4-diamino-6-pyrimidinyl)amino)-6-methyl-
TL;DR: 3-Pyridinethiol, 2-((2,4-diamino-6-pyrimidinyl)amino)-6-methyl- (CAS 81587-37-3) is a chemical compound with molecular formula C10H12N6S and molecular weight 248.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2,6-diaminopyrimidin-4-yl)amino]-6-methylpyridine-3-thiol
Also Known As: 3-Pyridinethiol, 2-((2,4-diamino-6-pyrimidinyl)amino)-6-methyl-, 2-[(2,6-diaminopyrimidin-4-yl)amino]-6-methylpyridine-3-thiol, 2-(2,4-Diaminopyrimidin-6-ylamino)-6-methyl-1H-pyridinium-3-thiolate, 2-[(2,4-Diamino-6-pyrimidinyl)amino]-6-methyl-3-pyridinethiol, 2-((2,4-DIAMINO-PYRIMIDIN-6-YL)AMINO)-6-METHYL-PYRIDINE-3-THIOL
| Molecular Formula | C10H12N6S |
|---|---|
| Molecular Weight | 248.08 g/mol |
| LogP | 1.37672 |
| Topological Polar Surface Area | 102.74 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 248.08441 |
| Heavy Atoms | 17 |
| Complexity | 536.23755 |
Chemical Identifiers
| CAS Number | 81587-37-3 |
|---|---|
| SMILES | CC1=NC(=C(C=C1)S)NC2=NC(=NC(=C2)N)N |
Product Overview
3-Pyridinethiol, 2-((2,4-diamino-6-pyrimidinyl)amino)-6-methyl- (CAS 81587-37-3), with molecular formula C10H12N6S and molecular weight 248.08 g/mol. IUPAC: 2-[(2,6-diaminopyrimidin-4-yl)amino]-6-methylpyridine-3-thiol.
Chemical Property Profile of 3-Pyridinethiol, 2-((2,4-diamino-6-pyrimidinyl)amino)-6-methyl-
Property Insights of 3-Pyridinethiol, 2-((2,4-diamino-6-pyrimidinyl)amino)-6-methyl-
The XLogP value of 1.37672 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Pyridinethiol, 2-((2,4-diamino-6-pyrimidinyl)amino)-6-methyl-. The TPSA of 102.74 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Pyridinethiol, 2-((2,4-diamino-6-pyrimidinyl)amino)-6-methyl-. Following Lipinski's Rule of Five, 3-Pyridinethiol, 2-((2,4-diamino-6-pyrimidinyl)amino)-6-methyl- has 4 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 3-Pyridinethiol, 2-((2,4-diamino-6-pyrimidinyl)amino)-6-methyl-?
The CAS number of 3-Pyridinethiol, 2-((2,4-diamino-6-pyrimidinyl)amino)-6-methyl- is 81587-37-3.
What is the molecular formula of 3-Pyridinethiol, 2-((2,4-diamino-6-pyrimidinyl)amino)-6-methyl-?
The molecular formula of 3-Pyridinethiol, 2-((2,4-diamino-6-pyrimidinyl)amino)-6-methyl- is C10H12N6S.
What is the molecular weight of 3-Pyridinethiol, 2-((2,4-diamino-6-pyrimidinyl)amino)-6-methyl-?
The molecular weight of 3-Pyridinethiol, 2-((2,4-diamino-6-pyrimidinyl)amino)-6-methyl- is 248.08 g/mol.
Where can I buy 3-Pyridinethiol, 2-((2,4-diamino-6-pyrimidinyl)amino)-6-methyl-?
You can request a quote for 3-Pyridinethiol, 2-((2,4-diamino-6-pyrimidinyl)amino)-6-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Pyridinethiol, 2-((2,4-diamino-6-pyrimidinyl)amino)-6-methyl-?
Yes, KEHONG BIO provides custom synthesis services for 3-Pyridinethiol, 2-((2,4-diamino-6-pyrimidinyl)amino)-6-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.