2'-Demethylpiritrexim
TL;DR: 2'-Demethylpiritrexim (CAS 118252-37-2) is a chemical compound with molecular formula C16H17N5O2 and molecular weight 311.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2,4-diamino-5-methylpyrido[2,3-d]pyrimidin-6-yl)methyl]-4-methoxyphenol
Also Known As: 2'-Demethylpiritrexim, 2/'-Demethylpiritrexim, 2 -Demethylpiritrexim, 2-[(2,4-diamino-5-methylpyrido[2,3-d]pyrimidin-6-yl)methyl]-4-methoxyphenol, Phenol, 2-((2,4-diamino-5-methylpyrido(2,3-d)pyrimidin-6-yl)methyl)-4-methoxy-
| Molecular Formula | C16H17N5O2 |
|---|---|
| Molecular Weight | 311.14 g/mol |
| LogP | 1.80262 |
| Topological Polar Surface Area | 120.17 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 311.1382 |
| Heavy Atoms | 23 |
| Complexity | 895.26324 |
Chemical Identifiers
| CAS Number | 118252-37-2 |
|---|---|
| SMILES | CC1=C2C(=NC(=NC2=NC=C1CC3=C(C=CC(=C3)OC)O)N)N |
Product Overview
2'-Demethylpiritrexim (CAS 118252-37-2), with molecular formula C16H17N5O2 and molecular weight 311.14 g/mol. IUPAC: 2-[(2,4-diamino-5-methylpyrido[2,3-d]pyrimidin-6-yl)methyl]-4-methoxyphenol.
Chemical Property Profile of 2'-Demethylpiritrexim
Property Insights of 2'-Demethylpiritrexim
The XLogP value of 1.80262 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2'-Demethylpiritrexim. The TPSA of 120.17 Ų falls within the moderate polarity range, balancing permeability and solubility for 2'-Demethylpiritrexim. Following Lipinski's Rule of Five, 2'-Demethylpiritrexim has 3 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 2'-Demethylpiritrexim?
The CAS number of 2'-Demethylpiritrexim is 118252-37-2.
What is the molecular formula of 2'-Demethylpiritrexim?
The molecular formula of 2'-Demethylpiritrexim is C16H17N5O2.
What is the molecular weight of 2'-Demethylpiritrexim?
The molecular weight of 2'-Demethylpiritrexim is 311.14 g/mol.
Where can I buy 2'-Demethylpiritrexim?
You can request a quote for 2'-Demethylpiritrexim directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2'-Demethylpiritrexim?
Yes, KEHONG BIO provides custom synthesis services for 2'-Demethylpiritrexim and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.