5-(3-Methylbutyl)pyrimidine-2,4,6-triamine
TL;DR: 5-(3-Methylbutyl)pyrimidine-2,4,6-triamine (CAS 4038-50-0) is a chemical compound with molecular formula C9H17N5 and molecular weight 195.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(3-methylbutyl)pyrimidine-2,4,6-triamine
Also Known As: 5-(3-methylbutyl)pyrimidine-2,4,6-triamine
| Molecular Formula | C9H17N5 |
|---|---|
| Molecular Weight | 195.15 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 104.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 195.14839 |
| Heavy Atoms | 14 |
| Complexity | 161.0 |
Chemical Identifiers
| CAS Number | 4038-50-0 |
|---|---|
| SMILES | CC(C)CCC1=C(N=C(N=C1N)N)N |
| InChIKey | QFIPQIKUKFISPM-UHFFFAOYSA-N |
Product Overview
5-(3-Methylbutyl)pyrimidine-2,4,6-triamine (CAS 4038-50-0), with molecular formula C9H17N5 and molecular weight 195.15 g/mol. IUPAC: 5-(3-methylbutyl)pyrimidine-2,4,6-triamine.
Chemical Property Profile of 5-(3-Methylbutyl)pyrimidine-2,4,6-triamine
Property Insights of 5-(3-Methylbutyl)pyrimidine-2,4,6-triamine
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(3-Methylbutyl)pyrimidine-2,4,6-triamine. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(3-Methylbutyl)pyrimidine-2,4,6-triamine. Following Lipinski's Rule of Five, 5-(3-Methylbutyl)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 5-(3-Methylbutyl)pyrimidine-2,4,6-triamine?
The CAS number of 5-(3-Methylbutyl)pyrimidine-2,4,6-triamine is 4038-50-0.
What is the molecular formula of 5-(3-Methylbutyl)pyrimidine-2,4,6-triamine?
The molecular formula of 5-(3-Methylbutyl)pyrimidine-2,4,6-triamine is C9H17N5.
What is the molecular weight of 5-(3-Methylbutyl)pyrimidine-2,4,6-triamine?
The molecular weight of 5-(3-Methylbutyl)pyrimidine-2,4,6-triamine is 195.15 g/mol.
Where can I buy 5-(3-Methylbutyl)pyrimidine-2,4,6-triamine?
You can request a quote for 5-(3-Methylbutyl)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 5-(3-Methylbutyl)pyrimidine-2,4,6-triamine?
Yes, KEHONG BIO provides custom synthesis services for 5-(3-Methylbutyl)pyrimidine-2,4,6-triamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.