(3R,4S)-4-(tert-butoxycarbonylamino)-3-hydroxy-6-methylheptanoic acid
TL;DR: (3R,4S)-4-(tert-butoxycarbonylamino)-3-hydroxy-6-methylheptanoic acid (CAS 82010-28-4) is a chemical compound with molecular formula C13H25NO5 and molecular weight 275.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-hydroxy-6-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]heptanoic acid
Also Known As: Boc-statine, Boc-epi-statine, BOC-STA-OH, Boc-(3S,4S)-4-amino-3-hydroxy-6-methylheptanoic acid, 3-hydroxy-6-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]heptanoic Acid
| Molecular Formula | C13H25NO5 |
|---|---|
| Molecular Weight | 275.17 g/mol |
| LogP | 1.7614 |
| Topological Polar Surface Area | 95.86 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 275.17328 |
| Heavy Atoms | 19 |
| Complexity | 308.64566 |
Chemical Identifiers
| CAS Number | 82010-28-4 |
|---|---|
| SMILES | CC(C)CC(C(CC(=O)O)O)NC(=O)OC(C)(C)C |
Product Overview
(3R,4S)-4-(tert-butoxycarbonylamino)-3-hydroxy-6-methylheptanoic acid (CAS 82010-28-4), with molecular formula C13H25NO5 and molecular weight 275.17 g/mol. IUPAC: 3-hydroxy-6-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]heptanoic acid.
Chemical Property Profile of (3R,4S)-4-(tert-butoxycarbonylamino)-3-hydroxy-6-methylheptanoic acid
Property Insights of (3R,4S)-4-(tert-butoxycarbonylamino)-3-hydroxy-6-methylheptanoic acid
The XLogP value of 1.7614 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3R,4S)-4-(tert-butoxycarbonylamino)-3-hydroxy-6-methylheptanoic acid. The TPSA of 95.86 Ų falls within the moderate polarity range, balancing permeability and solubility for (3R,4S)-4-(tert-butoxycarbonylamino)-3-hydroxy-6-methylheptanoic acid. Following Lipinski's Rule of Five, (3R,4S)-4-(tert-butoxycarbonylamino)-3-hydroxy-6-methylheptanoic acid has 3 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 (3R,4S)-4-(tert-butoxycarbonylamino)-3-hydroxy-6-methylheptanoic acid?
The CAS number of (3R,4S)-4-(tert-butoxycarbonylamino)-3-hydroxy-6-methylheptanoic acid is 82010-28-4.
What is the molecular formula of (3R,4S)-4-(tert-butoxycarbonylamino)-3-hydroxy-6-methylheptanoic acid?
The molecular formula of (3R,4S)-4-(tert-butoxycarbonylamino)-3-hydroxy-6-methylheptanoic acid is C13H25NO5.
What is the molecular weight of (3R,4S)-4-(tert-butoxycarbonylamino)-3-hydroxy-6-methylheptanoic acid?
The molecular weight of (3R,4S)-4-(tert-butoxycarbonylamino)-3-hydroxy-6-methylheptanoic acid is 275.17 g/mol.
Where can I buy (3R,4S)-4-(tert-butoxycarbonylamino)-3-hydroxy-6-methylheptanoic acid?
You can request a quote for (3R,4S)-4-(tert-butoxycarbonylamino)-3-hydroxy-6-methylheptanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3R,4S)-4-(tert-butoxycarbonylamino)-3-hydroxy-6-methylheptanoic acid?
Yes, KEHONG BIO provides custom synthesis services for (3R,4S)-4-(tert-butoxycarbonylamino)-3-hydroxy-6-methylheptanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.