![2-[(1r,3s,5R,7S)-3-acetamidoadamantan-1-yl]acetic acid structure](/static/products/7566/75667-93-5.webp)
2-[(1r,3s,5R,7S)-3-acetamidoadamantan-1-yl]acetic acid
TL;DR: 2-[(1r,3s,5R,7S)-3-acetamidoadamantan-1-yl]acetic acid (CAS 75667-93-5) is a chemical compound with molecular formula C14H21NO3 and molecular weight 251.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(5S,7R)-3-acetamido-1-adamantyl]acetic acid
Also Known As: 2-(3-Acetamidoadamantan-1-yl)acetic acid, 3-ACETYLAMINO-1-ADAMANTANE ACETIC ACID, 2-[(5S,7R)-3-acetamido-1-adamantyl]acetic acid, 2-[(1r,3s,5R,7S)-3-acetamidoadamantan-1-yl]acetic acid
| Molecular Formula | C14H21NO3 |
|---|---|
| Molecular Weight | 251.15 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 251.15215 |
| Heavy Atoms | 18 |
| Complexity | 390.0 |
Chemical Identifiers
| CAS Number | 75667-93-5 |
|---|---|
| SMILES | CC(=O)NC12C[C@@H]3C[C@H](C1)CC(C3)(C2)CC(=O)O |
| InChIKey | WGQQQEFRSGVMSR-WHCAJBEMSA-N |
Product Overview
2-[(1r,3s,5R,7S)-3-acetamidoadamantan-1-yl]acetic acid (CAS 75667-93-5), with molecular formula C14H21NO3 and molecular weight 251.15 g/mol. IUPAC: 2-[(5S,7R)-3-acetamido-1-adamantyl]acetic acid.
Chemical Property Profile of 2-[(1r,3s,5R,7S)-3-acetamidoadamantan-1-yl]acetic acid
Property Insights of 2-[(1r,3s,5R,7S)-3-acetamidoadamantan-1-yl]acetic acid
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(1r,3s,5R,7S)-3-acetamidoadamantan-1-yl]acetic acid. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(1r,3s,5R,7S)-3-acetamidoadamantan-1-yl]acetic acid. Following Lipinski's Rule of Five, 2-[(1r,3s,5R,7S)-3-acetamidoadamantan-1-yl]acetic 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 2-[(1r,3s,5R,7S)-3-acetamidoadamantan-1-yl]acetic acid?
The CAS number of 2-[(1r,3s,5R,7S)-3-acetamidoadamantan-1-yl]acetic acid is 75667-93-5.
What is the molecular formula of 2-[(1r,3s,5R,7S)-3-acetamidoadamantan-1-yl]acetic acid?
The molecular formula of 2-[(1r,3s,5R,7S)-3-acetamidoadamantan-1-yl]acetic acid is C14H21NO3.
What is the molecular weight of 2-[(1r,3s,5R,7S)-3-acetamidoadamantan-1-yl]acetic acid?
The molecular weight of 2-[(1r,3s,5R,7S)-3-acetamidoadamantan-1-yl]acetic acid is 251.15 g/mol.
Where can I buy 2-[(1r,3s,5R,7S)-3-acetamidoadamantan-1-yl]acetic acid?
You can request a quote for 2-[(1r,3s,5R,7S)-3-acetamidoadamantan-1-yl]acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(1r,3s,5R,7S)-3-acetamidoadamantan-1-yl]acetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[(1r,3s,5R,7S)-3-acetamidoadamantan-1-yl]acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.