2,4-Pteridinediamine, 6-((3,4-dimethoxyphenylthio)methyl)-
TL;DR: 2,4-Pteridinediamine, 6-((3,4-dimethoxyphenylthio)methyl)- (CAS 174654-77-4) is a chemical compound with molecular formula C15H16N6O2S and molecular weight 344.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[(3,4-dimethoxyphenyl)sulfanylmethyl]pteridine-2,4-diamine
Also Known As: 2,4-Diaminopteridine der., 2,4-Pteridinediamine, 6-((3,4-dimethoxyphenylthio)methyl)-, 6-[(3,4-dimethoxyphenyl)sulfanylmethyl]pteridine-2,4-diamine, 2,4-Pteridinediamine, 6-[(3,4-dimethoxyphenylthio)methyl], 2,4-Pteridinediamine, 6-[[(3,4-dimethoxyphenyl)thio]methyl]-
| Molecular Formula | C15H16N6O2S |
|---|---|
| Molecular Weight | 344.11 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 147.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 5 |
| Exact Mass | 344.10553 |
| Heavy Atoms | 24 |
| Complexity | 406.0 |
Chemical Identifiers
| CAS Number | 174654-77-4 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)SCC2=CN=C3C(=N2)C(=NC(=N3)N)N)OC |
| InChIKey | KVVYXYFMGZBRSZ-UHFFFAOYSA-N |
Product Overview
2,4-Pteridinediamine, 6-((3,4-dimethoxyphenylthio)methyl)- (CAS 174654-77-4), with molecular formula C15H16N6O2S and molecular weight 344.11 g/mol. IUPAC: 6-[(3,4-dimethoxyphenyl)sulfanylmethyl]pteridine-2,4-diamine.
Chemical Property Profile of 2,4-Pteridinediamine, 6-((3,4-dimethoxyphenylthio)methyl)-
Property Insights of 2,4-Pteridinediamine, 6-((3,4-dimethoxyphenylthio)methyl)-
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4-Pteridinediamine, 6-((3,4-dimethoxyphenylthio)methyl)-. The TPSA of 147.0 Ų indicates high polarity, suggesting 2,4-Pteridinediamine, 6-((3,4-dimethoxyphenylthio)methyl)- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2,4-Pteridinediamine, 6-((3,4-dimethoxyphenylthio)methyl)- has 2 hydrogen bond donor(s) and 9 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 2,4-Pteridinediamine, 6-((3,4-dimethoxyphenylthio)methyl)-?
The CAS number of 2,4-Pteridinediamine, 6-((3,4-dimethoxyphenylthio)methyl)- is 174654-77-4.
What is the molecular formula of 2,4-Pteridinediamine, 6-((3,4-dimethoxyphenylthio)methyl)-?
The molecular formula of 2,4-Pteridinediamine, 6-((3,4-dimethoxyphenylthio)methyl)- is C15H16N6O2S.
What is the molecular weight of 2,4-Pteridinediamine, 6-((3,4-dimethoxyphenylthio)methyl)-?
The molecular weight of 2,4-Pteridinediamine, 6-((3,4-dimethoxyphenylthio)methyl)- is 344.11 g/mol.
Where can I buy 2,4-Pteridinediamine, 6-((3,4-dimethoxyphenylthio)methyl)-?
You can request a quote for 2,4-Pteridinediamine, 6-((3,4-dimethoxyphenylthio)methyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-Pteridinediamine, 6-((3,4-dimethoxyphenylthio)methyl)-?
Yes, KEHONG BIO provides custom synthesis services for 2,4-Pteridinediamine, 6-((3,4-dimethoxyphenylthio)methyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.