Acetic acid, 2-(1-phthalazinylthio)-
TL;DR: Acetic acid, 2-(1-phthalazinylthio)- (CAS 314027-92-4) is a chemical compound with molecular formula C10H8N2O2S and molecular weight 220.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-phthalazin-1-ylsulfanylacetic acid
Also Known As: IDO-IN-18, (phthalazin-1-ylthio)acetic acid, ChemDiv1_001624, Acetic acid, 2-(1-phthalazinylthio)-, 2-phthalazinylthioacetic acid
| Molecular Formula | C10H8N2O2S |
|---|---|
| Molecular Weight | 220.03 g/mol |
| LogP | 1.8065 |
| Topological Polar Surface Area | 63.08 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 220.03065 |
| Heavy Atoms | 15 |
| Complexity | 496.2513 |
Chemical Identifiers
| CAS Number | 314027-92-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=NN=C2SCC(=O)O |
Product Overview
Acetic acid, 2-(1-phthalazinylthio)- (CAS 314027-92-4), with molecular formula C10H8N2O2S and molecular weight 220.03 g/mol. IUPAC: 2-phthalazin-1-ylsulfanylacetic acid.
Chemical Property Profile of Acetic acid, 2-(1-phthalazinylthio)-
Property Insights of Acetic acid, 2-(1-phthalazinylthio)-
The XLogP value of 1.8065 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetic acid, 2-(1-phthalazinylthio)-. The TPSA of 63.08 Ų falls within the moderate polarity range, balancing permeability and solubility for Acetic acid, 2-(1-phthalazinylthio)-. Following Lipinski's Rule of Five, Acetic acid, 2-(1-phthalazinylthio)- has 1 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 Acetic acid, 2-(1-phthalazinylthio)-?
The CAS number of Acetic acid, 2-(1-phthalazinylthio)- is 314027-92-4.
What is the molecular formula of Acetic acid, 2-(1-phthalazinylthio)-?
The molecular formula of Acetic acid, 2-(1-phthalazinylthio)- is C10H8N2O2S.
What is the molecular weight of Acetic acid, 2-(1-phthalazinylthio)-?
The molecular weight of Acetic acid, 2-(1-phthalazinylthio)- is 220.03 g/mol.
Where can I buy Acetic acid, 2-(1-phthalazinylthio)-?
You can request a quote for Acetic acid, 2-(1-phthalazinylthio)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetic acid, 2-(1-phthalazinylthio)-?
Yes, KEHONG BIO provides custom synthesis services for Acetic acid, 2-(1-phthalazinylthio)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.