3,4-Diisovaleryl adrenalone
TL;DR: 3,4-Diisovaleryl adrenalone (CAS 98495-22-8) is a chemical compound with molecular formula C19H27NO5 and molecular weight 349.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[2-(methylamino)acetyl]-2-(2-methylbutanoyloxy)phenyl] 2-methylbutanoate
Also Known As: Agp-dermorphin, 3,4-Diisovaleryl adrenalone, 2-Arg-3-gly-4-phe-dermorphin, Dermorphin, arg(2)-gly(3)-phe(4)-, Butanoic acid, 3-methyl-, (11beta,16alpha)-
| Molecular Formula | C19H27NO5 |
|---|---|
| Molecular Weight | 349.19 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 81.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 11 |
| Exact Mass | 349.18893 |
| Heavy Atoms | 25 |
| Complexity | 465.0 |
Chemical Identifiers
| CAS Number | 98495-22-8 |
|---|---|
| SMILES | CCC(C)C(=O)OC1=C(C=C(C=C1)C(=O)CNC)OC(=O)C(C)CC |
| InChIKey | MUULHPNPXBMEQL-UHFFFAOYSA-N |
Product Overview
3,4-Diisovaleryl adrenalone (CAS 98495-22-8), with molecular formula C19H27NO5 and molecular weight 349.19 g/mol. IUPAC: [4-[2-(methylamino)acetyl]-2-(2-methylbutanoyloxy)phenyl] 2-methylbutanoate.
Chemical Property Profile of 3,4-Diisovaleryl adrenalone
Property Insights of 3,4-Diisovaleryl adrenalone
The XLogP value of 3.5 indicates that 3,4-Diisovaleryl adrenalone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,4-Diisovaleryl adrenalone. Following Lipinski's Rule of Five, 3,4-Diisovaleryl adrenalone has 1 hydrogen bond donor(s) and 6 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 3,4-Diisovaleryl adrenalone?
The CAS number of 3,4-Diisovaleryl adrenalone is 98495-22-8.
What is the molecular formula of 3,4-Diisovaleryl adrenalone?
The molecular formula of 3,4-Diisovaleryl adrenalone is C19H27NO5.
What is the molecular weight of 3,4-Diisovaleryl adrenalone?
The molecular weight of 3,4-Diisovaleryl adrenalone is 349.19 g/mol.
Where can I buy 3,4-Diisovaleryl adrenalone?
You can request a quote for 3,4-Diisovaleryl adrenalone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-Diisovaleryl adrenalone?
Yes, KEHONG BIO provides custom synthesis services for 3,4-Diisovaleryl adrenalone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.