![(S)-3-methyl-2-(2-((4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-7-yl)oxy)acetamido)butanoic acid structure](/static/products/956/956962-49-5.png)
(S)-3-methyl-2-(2-((4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-7-yl)oxy)acetamido)butanoic acid
TL;DR: (S)-3-methyl-2-(2-((4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-7-yl)oxy)acetamido)butanoic acid (CAS 956962-49-5) is a chemical compound with molecular formula C19H21NO6 and molecular weight 359.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-3-methyl-2-[[2-[(4-oxo-2,3-dihydro-1H-cyclopenta[c]chromen-7-yl)oxy]acetyl]amino]butanoic acid
Also Known As: (S)-3-methyl-2-(2-((4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-7-yl)oxy)acetamido)butanoic acid, (2S)-3-methyl-2-[[2-[(4-oxo-2,3-dihydro-1H-cyclopenta[c]chromen-7-yl)oxy]acetyl]amino]butanoic acid
| Molecular Formula | C19H21NO6 |
|---|---|
| Molecular Weight | 359.14 g/mol |
| LogP | 1.8859 |
| Topological Polar Surface Area | 105.84 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 359.1369 |
| Heavy Atoms | 26 |
| Complexity | 914.12067 |
Chemical Identifiers
| CAS Number | 956962-49-5 |
|---|---|
| SMILES | CC(C)[C@@H](C(=O)O)NC(=O)COC1=CC2=C(C=C1)C3=C(CCC3)C(=O)O2 |
Product Overview
(S)-3-methyl-2-(2-((4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-7-yl)oxy)acetamido)butanoic acid (CAS 956962-49-5), with molecular formula C19H21NO6 and molecular weight 359.14 g/mol. IUPAC: (2S)-3-methyl-2-[[2-[(4-oxo-2,3-dihydro-1H-cyclopenta[c]chromen-7-yl)oxy]acetyl]amino]butanoic acid.
Chemical Property Profile of (S)-3-methyl-2-(2-((4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-7-yl)oxy)acetamido)butanoic acid
Property Insights of (S)-3-methyl-2-(2-((4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-7-yl)oxy)acetamido)butanoic acid
The XLogP value of 1.8859 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-3-methyl-2-(2-((4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-7-yl)oxy)acetamido)butanoic acid. The TPSA of 105.84 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-3-methyl-2-(2-((4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-7-yl)oxy)acetamido)butanoic acid. Following Lipinski's Rule of Five, (S)-3-methyl-2-(2-((4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-7-yl)oxy)acetamido)butanoic acid has 2 hydrogen bond donor(s) and 5 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 (S)-3-methyl-2-(2-((4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-7-yl)oxy)acetamido)butanoic acid?
The CAS number of (S)-3-methyl-2-(2-((4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-7-yl)oxy)acetamido)butanoic acid is 956962-49-5.
What is the molecular formula of (S)-3-methyl-2-(2-((4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-7-yl)oxy)acetamido)butanoic acid?
The molecular formula of (S)-3-methyl-2-(2-((4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-7-yl)oxy)acetamido)butanoic acid is C19H21NO6.
What is the molecular weight of (S)-3-methyl-2-(2-((4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-7-yl)oxy)acetamido)butanoic acid?
The molecular weight of (S)-3-methyl-2-(2-((4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-7-yl)oxy)acetamido)butanoic acid is 359.14 g/mol.
Where can I buy (S)-3-methyl-2-(2-((4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-7-yl)oxy)acetamido)butanoic acid?
You can request a quote for (S)-3-methyl-2-(2-((4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-7-yl)oxy)acetamido)butanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (S)-3-methyl-2-(2-((4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-7-yl)oxy)acetamido)butanoic acid?
Yes, KEHONG BIO provides custom synthesis services for (S)-3-methyl-2-(2-((4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-7-yl)oxy)acetamido)butanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.