![(3S)-3-{[(tert-butoxy)carbonyl]amino}-4-methylpentanoic acid structure](/static/products/183/183990-64-9.png)
(3S)-3-{[(tert-butoxy)carbonyl]amino}-4-methylpentanoic acid
TL;DR: (3S)-3-{[(tert-butoxy)carbonyl]amino}-4-methylpentanoic acid (CAS 183990-64-9) is a chemical compound with molecular formula C11H21NO4 and molecular weight 231.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S)-4-methyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoic acid
Also Known As: Boc-D-beta-homovaline, Boc-D-beta-Leucine, Boc-D--homovaline, Boc-HoVal-OH, Boc-D-Asp-OBut
| Molecular Formula | C11H21NO4 |
|---|---|
| Molecular Weight | 231.15 g/mol |
| LogP | 2.0104 |
| Topological Polar Surface Area | 75.63 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 231.14706 |
| Heavy Atoms | 16 |
| Complexity | 255.20041 |
Chemical Identifiers
| CAS Number | 183990-64-9 |
|---|---|
| SMILES | CC(C)[C@H](CC(=O)O)NC(=O)OC(C)(C)C |
Product Overview
(3S)-3-{[(tert-butoxy)carbonyl]amino}-4-methylpentanoic acid (CAS 183990-64-9), with molecular formula C11H21NO4 and molecular weight 231.15 g/mol. IUPAC: (3S)-4-methyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoic acid.
Chemical Property Profile of (3S)-3-{[(tert-butoxy)carbonyl]amino}-4-methylpentanoic acid
Property Insights of (3S)-3-{[(tert-butoxy)carbonyl]amino}-4-methylpentanoic acid
The XLogP value of 2.0104 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3S)-3-{[(tert-butoxy)carbonyl]amino}-4-methylpentanoic acid. The TPSA of 75.63 Ų falls within the moderate polarity range, balancing permeability and solubility for (3S)-3-{[(tert-butoxy)carbonyl]amino}-4-methylpentanoic acid. Following Lipinski's Rule of Five, (3S)-3-{[(tert-butoxy)carbonyl]amino}-4-methylpentanoic acid has 2 hydrogen bond donor(s) and 3 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 (3S)-3-{[(tert-butoxy)carbonyl]amino}-4-methylpentanoic acid?
The CAS number of (3S)-3-{[(tert-butoxy)carbonyl]amino}-4-methylpentanoic acid is 183990-64-9.
What is the molecular formula of (3S)-3-{[(tert-butoxy)carbonyl]amino}-4-methylpentanoic acid?
The molecular formula of (3S)-3-{[(tert-butoxy)carbonyl]amino}-4-methylpentanoic acid is C11H21NO4.
What is the molecular weight of (3S)-3-{[(tert-butoxy)carbonyl]amino}-4-methylpentanoic acid?
The molecular weight of (3S)-3-{[(tert-butoxy)carbonyl]amino}-4-methylpentanoic acid is 231.15 g/mol.
Where can I buy (3S)-3-{[(tert-butoxy)carbonyl]amino}-4-methylpentanoic acid?
You can request a quote for (3S)-3-{[(tert-butoxy)carbonyl]amino}-4-methylpentanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3S)-3-{[(tert-butoxy)carbonyl]amino}-4-methylpentanoic acid?
Yes, KEHONG BIO provides custom synthesis services for (3S)-3-{[(tert-butoxy)carbonyl]amino}-4-methylpentanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.