4-N-(3,4-dimethylphenyl)pyrimidine-2,4,6-triamine
TL;DR: 4-N-(3,4-dimethylphenyl)pyrimidine-2,4,6-triamine (CAS 96117-06-5) is a chemical compound with molecular formula C12H15N5 and molecular weight 229.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-N-(3,4-dimethylphenyl)pyrimidine-2,4,6-triamine
Also Known As: N4-(3,4-dimethyl-phenyl)-pyrimidine-2,4,6-triamine, 4-N-(3,4-dimethylphenyl)pyrimidine-2,4,6-triamine
| Molecular Formula | C12H15N5 |
|---|---|
| Molecular Weight | 229.13 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 89.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 229.13275 |
| Heavy Atoms | 17 |
| Complexity | 247.0 |
Chemical Identifiers
| CAS Number | 96117-06-5 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)NC2=NC(=NC(=C2)N)N)C |
| InChIKey | WACUVLDFPVBPAT-UHFFFAOYSA-N |
Product Overview
4-N-(3,4-dimethylphenyl)pyrimidine-2,4,6-triamine (CAS 96117-06-5), with molecular formula C12H15N5 and molecular weight 229.13 g/mol. IUPAC: 4-N-(3,4-dimethylphenyl)pyrimidine-2,4,6-triamine.
Chemical Property Profile of 4-N-(3,4-dimethylphenyl)pyrimidine-2,4,6-triamine
Property Insights of 4-N-(3,4-dimethylphenyl)pyrimidine-2,4,6-triamine
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-N-(3,4-dimethylphenyl)pyrimidine-2,4,6-triamine. The TPSA of 89.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-N-(3,4-dimethylphenyl)pyrimidine-2,4,6-triamine. Following Lipinski's Rule of Five, 4-N-(3,4-dimethylphenyl)pyrimidine-2,4,6-triamine has 3 hydrogen bond donor(s) and 5 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 4-N-(3,4-dimethylphenyl)pyrimidine-2,4,6-triamine?
The CAS number of 4-N-(3,4-dimethylphenyl)pyrimidine-2,4,6-triamine is 96117-06-5.
What is the molecular formula of 4-N-(3,4-dimethylphenyl)pyrimidine-2,4,6-triamine?
The molecular formula of 4-N-(3,4-dimethylphenyl)pyrimidine-2,4,6-triamine is C12H15N5.
What is the molecular weight of 4-N-(3,4-dimethylphenyl)pyrimidine-2,4,6-triamine?
The molecular weight of 4-N-(3,4-dimethylphenyl)pyrimidine-2,4,6-triamine is 229.13 g/mol.
Where can I buy 4-N-(3,4-dimethylphenyl)pyrimidine-2,4,6-triamine?
You can request a quote for 4-N-(3,4-dimethylphenyl)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 4-N-(3,4-dimethylphenyl)pyrimidine-2,4,6-triamine?
Yes, KEHONG BIO provides custom synthesis services for 4-N-(3,4-dimethylphenyl)pyrimidine-2,4,6-triamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.