2-(4,6-Dimethyl-pyrimidin-2-ylamino)-3-methyl-butyric acid
TL;DR: 2-(4,6-Dimethyl-pyrimidin-2-ylamino)-3-methyl-butyric acid (CAS 1008675-58-8) is a chemical compound with molecular formula C11H17N3O2 and molecular weight 223.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4,6-dimethylpyrimidin-2-yl)amino]-3-methylbutanoic acid
Also Known As: 2-(4,6-Dimethyl-pyrimidin-2-ylamino)-3-methyl-butyric acid, (4,6-dimethylpyrimidin-2-yl)valine, ASN 12965736, N-(4,6-dimethyl-2-pyrimidinyl)valine, 2-[(4,6-dimethylpyrimidin-2-yl)amino]-3-methylbutanoic acid
| Molecular Formula | C11H17N3O2 |
|---|---|
| Molecular Weight | 223.13 g/mol |
| LogP | 1.61454 |
| Topological Polar Surface Area | 75.11 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 223.13208 |
| Heavy Atoms | 16 |
| Complexity | 370.5661 |
Chemical Identifiers
| CAS Number | 1008675-58-8 |
|---|---|
| SMILES | CC1=CC(=NC(=N1)NC(C(C)C)C(=O)O)C |
Product Overview
2-(4,6-Dimethyl-pyrimidin-2-ylamino)-3-methyl-butyric acid (CAS 1008675-58-8), with molecular formula C11H17N3O2 and molecular weight 223.13 g/mol. IUPAC: 2-[(4,6-dimethylpyrimidin-2-yl)amino]-3-methylbutanoic acid.
Chemical Property Profile of 2-(4,6-Dimethyl-pyrimidin-2-ylamino)-3-methyl-butyric acid
Property Insights of 2-(4,6-Dimethyl-pyrimidin-2-ylamino)-3-methyl-butyric acid
The XLogP value of 1.61454 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4,6-Dimethyl-pyrimidin-2-ylamino)-3-methyl-butyric acid. The TPSA of 75.11 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4,6-Dimethyl-pyrimidin-2-ylamino)-3-methyl-butyric acid. Following Lipinski's Rule of Five, 2-(4,6-Dimethyl-pyrimidin-2-ylamino)-3-methyl-butyric acid has 2 hydrogen bond donor(s) and 4 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-(4,6-Dimethyl-pyrimidin-2-ylamino)-3-methyl-butyric acid?
The CAS number of 2-(4,6-Dimethyl-pyrimidin-2-ylamino)-3-methyl-butyric acid is 1008675-58-8.
What is the molecular formula of 2-(4,6-Dimethyl-pyrimidin-2-ylamino)-3-methyl-butyric acid?
The molecular formula of 2-(4,6-Dimethyl-pyrimidin-2-ylamino)-3-methyl-butyric acid is C11H17N3O2.
What is the molecular weight of 2-(4,6-Dimethyl-pyrimidin-2-ylamino)-3-methyl-butyric acid?
The molecular weight of 2-(4,6-Dimethyl-pyrimidin-2-ylamino)-3-methyl-butyric acid is 223.13 g/mol.
Where can I buy 2-(4,6-Dimethyl-pyrimidin-2-ylamino)-3-methyl-butyric acid?
You can request a quote for 2-(4,6-Dimethyl-pyrimidin-2-ylamino)-3-methyl-butyric acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4,6-Dimethyl-pyrimidin-2-ylamino)-3-methyl-butyric acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(4,6-Dimethyl-pyrimidin-2-ylamino)-3-methyl-butyric acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.