n4-(3,4,5-Trimethoxyphenyl)pyrimidine-2,4,6-triamine
TL;DR: n4-(3,4,5-Trimethoxyphenyl)pyrimidine-2,4,6-triamine (CAS 31621-91-7) is a chemical compound with molecular formula C13H17N5O3 and molecular weight 291.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-N-(3,4,5-trimethoxyphenyl)pyrimidine-2,4,6-triamine
Also Known As: n4-(3,4,5-trimethoxyphenyl)pyrimidine-2,4,6-triamine, 4-N-(3,4,5-trimethoxyphenyl)pyrimidine-2,4,6-triamine, N~4~-(3,4,5-Trimethoxyphenyl)pyrimidine-2,4,6-triamine
| Molecular Formula | C13H17N5O3 |
|---|---|
| Molecular Weight | 291.13 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 118.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 291.13315 |
| Heavy Atoms | 21 |
| Complexity | 308.0 |
Chemical Identifiers
| CAS Number | 31621-91-7 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)NC2=NC(=NC(=C2)N)N |
| InChIKey | VRGBEHJWNPOPMG-UHFFFAOYSA-N |
Product Overview
n4-(3,4,5-Trimethoxyphenyl)pyrimidine-2,4,6-triamine (CAS 31621-91-7), with molecular formula C13H17N5O3 and molecular weight 291.13 g/mol. IUPAC: 4-N-(3,4,5-trimethoxyphenyl)pyrimidine-2,4,6-triamine.
Chemical Property Profile of n4-(3,4,5-Trimethoxyphenyl)pyrimidine-2,4,6-triamine
Property Insights of n4-(3,4,5-Trimethoxyphenyl)pyrimidine-2,4,6-triamine
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for n4-(3,4,5-Trimethoxyphenyl)pyrimidine-2,4,6-triamine. The TPSA of 118.0 Ų falls within the moderate polarity range, balancing permeability and solubility for n4-(3,4,5-Trimethoxyphenyl)pyrimidine-2,4,6-triamine. Following Lipinski's Rule of Five, n4-(3,4,5-Trimethoxyphenyl)pyrimidine-2,4,6-triamine has 3 hydrogen bond donor(s) and 8 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 n4-(3,4,5-Trimethoxyphenyl)pyrimidine-2,4,6-triamine?
The CAS number of n4-(3,4,5-Trimethoxyphenyl)pyrimidine-2,4,6-triamine is 31621-91-7.
What is the molecular formula of n4-(3,4,5-Trimethoxyphenyl)pyrimidine-2,4,6-triamine?
The molecular formula of n4-(3,4,5-Trimethoxyphenyl)pyrimidine-2,4,6-triamine is C13H17N5O3.
What is the molecular weight of n4-(3,4,5-Trimethoxyphenyl)pyrimidine-2,4,6-triamine?
The molecular weight of n4-(3,4,5-Trimethoxyphenyl)pyrimidine-2,4,6-triamine is 291.13 g/mol.
Where can I buy n4-(3,4,5-Trimethoxyphenyl)pyrimidine-2,4,6-triamine?
You can request a quote for n4-(3,4,5-Trimethoxyphenyl)pyrimidine-2,4,6-triamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for n4-(3,4,5-Trimethoxyphenyl)pyrimidine-2,4,6-triamine?
Yes, KEHONG BIO provides custom synthesis services for n4-(3,4,5-Trimethoxyphenyl)pyrimidine-2,4,6-triamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.