2-(3-Pyridylmethylthio)pyrimidine-4,6-diamine
TL;DR: 2-(3-Pyridylmethylthio)pyrimidine-4,6-diamine (CAS 95016-51-6) is a chemical compound with molecular formula C10H11N5S and molecular weight 233.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(pyridin-3-ylmethylsulfanyl)pyrimidine-4,6-diamine
Also Known As: CBKinase1_008569, CBKinase1_020969, 2-(3-pyridylmethylthio)pyrimidine-4,6-diamine, 2-(pyridin-3-ylmethylsulfanyl)pyrimidine-4,6-diamine, 2-[(3-pyridinylmethyl)sulfanyl]-4,6-pyrimidinediamine
| Molecular Formula | C10H11N5S |
|---|---|
| Molecular Weight | 233.07 g/mol |
| LogP | 1.3283 |
| Topological Polar Surface Area | 90.71 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 233.07352 |
| Heavy Atoms | 16 |
| Complexity | 453.64053 |
Chemical Identifiers
| CAS Number | 95016-51-6 |
|---|---|
| SMILES | C1=CC(=CN=C1)CSC2=NC(=CC(=N2)N)N |
Product Overview
2-(3-Pyridylmethylthio)pyrimidine-4,6-diamine (CAS 95016-51-6), with molecular formula C10H11N5S and molecular weight 233.07 g/mol. IUPAC: 2-(pyridin-3-ylmethylsulfanyl)pyrimidine-4,6-diamine.
Chemical Property Profile of 2-(3-Pyridylmethylthio)pyrimidine-4,6-diamine
Property Insights of 2-(3-Pyridylmethylthio)pyrimidine-4,6-diamine
The XLogP value of 1.3283 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3-Pyridylmethylthio)pyrimidine-4,6-diamine. The TPSA of 90.71 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3-Pyridylmethylthio)pyrimidine-4,6-diamine. Following Lipinski's Rule of Five, 2-(3-Pyridylmethylthio)pyrimidine-4,6-diamine has 2 hydrogen bond donor(s) and 6 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 2-(3-Pyridylmethylthio)pyrimidine-4,6-diamine?
The CAS number of 2-(3-Pyridylmethylthio)pyrimidine-4,6-diamine is 95016-51-6.
What is the molecular formula of 2-(3-Pyridylmethylthio)pyrimidine-4,6-diamine?
The molecular formula of 2-(3-Pyridylmethylthio)pyrimidine-4,6-diamine is C10H11N5S.
What is the molecular weight of 2-(3-Pyridylmethylthio)pyrimidine-4,6-diamine?
The molecular weight of 2-(3-Pyridylmethylthio)pyrimidine-4,6-diamine is 233.07 g/mol.
Where can I buy 2-(3-Pyridylmethylthio)pyrimidine-4,6-diamine?
You can request a quote for 2-(3-Pyridylmethylthio)pyrimidine-4,6-diamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3-Pyridylmethylthio)pyrimidine-4,6-diamine?
Yes, KEHONG BIO provides custom synthesis services for 2-(3-Pyridylmethylthio)pyrimidine-4,6-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.