(S)-2-(4-hydroxyphthalazin-1-yl)propanoic acid
TL;DR: (S)-2-(4-hydroxyphthalazin-1-yl)propanoic acid (CAS 306967-28-2) is a chemical compound with molecular formula C11H10N2O3 and molecular weight 218.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-(4-oxo-3H-phthalazin-1-yl)propanoic acid
Also Known As: (2S)-2-(4-hydroxyphthalazin-1-yl)propanoic acid, (S)-2-(4-hydroxyphthalazin-1-yl)propanoic acid, (2S)-2-(4-oxo-3H-phthalazin-1-yl)propanoic acid
| Molecular Formula | C11H10N2O3 |
|---|---|
| Molecular Weight | 218.07 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 78.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 218.06914 |
| Heavy Atoms | 16 |
| Complexity | 351.0 |
Chemical Identifiers
| CAS Number | 306967-28-2 |
|---|---|
| SMILES | C[C@@H](C1=NNC(=O)C2=CC=CC=C21)C(=O)O |
| InChIKey | AACAKXDXYHEHDJ-LURJTMIESA-N |
Product Overview
(S)-2-(4-hydroxyphthalazin-1-yl)propanoic acid (CAS 306967-28-2), with molecular formula C11H10N2O3 and molecular weight 218.07 g/mol. IUPAC: (2S)-2-(4-oxo-3H-phthalazin-1-yl)propanoic acid.
Chemical Property Profile of (S)-2-(4-hydroxyphthalazin-1-yl)propanoic acid
Property Insights of (S)-2-(4-hydroxyphthalazin-1-yl)propanoic acid
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-2-(4-hydroxyphthalazin-1-yl)propanoic acid. The TPSA of 78.8 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-2-(4-hydroxyphthalazin-1-yl)propanoic acid. Following Lipinski's Rule of Five, (S)-2-(4-hydroxyphthalazin-1-yl)propanoic acid has 2 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 (S)-2-(4-hydroxyphthalazin-1-yl)propanoic acid?
The CAS number of (S)-2-(4-hydroxyphthalazin-1-yl)propanoic acid is 306967-28-2.
What is the molecular formula of (S)-2-(4-hydroxyphthalazin-1-yl)propanoic acid?
The molecular formula of (S)-2-(4-hydroxyphthalazin-1-yl)propanoic acid is C11H10N2O3.
What is the molecular weight of (S)-2-(4-hydroxyphthalazin-1-yl)propanoic acid?
The molecular weight of (S)-2-(4-hydroxyphthalazin-1-yl)propanoic acid is 218.07 g/mol.
Where can I buy (S)-2-(4-hydroxyphthalazin-1-yl)propanoic acid?
You can request a quote for (S)-2-(4-hydroxyphthalazin-1-yl)propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (S)-2-(4-hydroxyphthalazin-1-yl)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for (S)-2-(4-hydroxyphthalazin-1-yl)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.