5'-Demethylpiritrexim
TL;DR: 5'-Demethylpiritrexim (CAS 118252-38-3) is a chemical compound with molecular formula C16H17N5O2 and molecular weight 311.1382 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[(2,4-diamino-5-methylpyrido[2,3-d]pyrimidin-6-yl)methyl]-4-methoxyphenol
Also Known As: 5'-Demethylpiritrexim, 5/'-Demethylpiritrexim, 5 -Demethylpiritrexim, 3-[(2,4-diamino-5-methylpyrido[2,3-d]pyrimidin-6-yl)methyl]-4-methoxyphenol, Phenol, 3-((2,4-diamino-5-methylpyrido(2,3-d)pyrimidin-6-yl)methyl)-4-methoxy-
Technical Specifications
| Molecular Formula | C16H17N5O2 |
| Molecular Weight | 311.1382 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 120.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 311.1382 Da |
| Heavy Atoms | 23 |
| Complexity | 399.0 |
| SMILES | CC1=C2C(=NC(=NC2=NC=C1CC3=C(C=CC(=C3)O)OC)N)N |
| InChIKey | SYIGACSDZHBYAQ-UHFFFAOYSA-N |
Chemical Property Profile of 5'-Demethylpiritrexim
Property Insights of 5'-Demethylpiritrexim
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5'-Demethylpiritrexim. The TPSA of 120.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5'-Demethylpiritrexim. Following Lipinski's Rule of Five, 5'-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
What is the CAS number of 5'-Demethylpiritrexim?
The CAS number of 5'-Demethylpiritrexim is 118252-38-3.
What is the molecular formula of 5'-Demethylpiritrexim?
The molecular formula of 5'-Demethylpiritrexim is C16H17N5O2.
What is the molecular weight of 5'-Demethylpiritrexim?
The molecular weight of 5'-Demethylpiritrexim is 311.1382 g/mol.
Where can I buy 5'-Demethylpiritrexim?
You can request a quote for 5'-Demethylpiritrexim directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5'-Demethylpiritrexim?
Yes, CoreyChem provides custom synthesis services for 5'-Demethylpiritrexim and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.