Phenothiazine-2-acetic acid
TL;DR: Phenothiazine-2-acetic acid (CAS 20965-69-9) is a chemical compound with molecular formula C14H11NO2S and molecular weight 257.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(10H-phenothiazin-2-yl)acetic acid
Also Known As: Phenothiazine-2-acetic acid, Phenothiazinyl-2-essigsaeure, 2-(10H-phenothiazin-2-yl)acetic acid, 10H-Phenothiazine-2-acetic acid, (10H-Phenothiazin-2-yl)acetic acid
| Molecular Formula | C14H11NO2S |
|---|---|
| Molecular Weight | 257.05 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 257.05106 |
| Heavy Atoms | 18 |
| Complexity | 323.0 |
Chemical Identifiers
| CAS Number | 20965-69-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)NC3=C(S2)C=CC(=C3)CC(=O)O |
| InChIKey | IFKVERMEMGDLLL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Phenothiazine-2-acetic acid (CAS 20965-69-9), with molecular formula C14H11NO2S and molecular weight 257.05 g/mol. IUPAC: 2-(10H-phenothiazin-2-yl)acetic acid.
Chemical Property Profile of Phenothiazine-2-acetic acid
Property Insights of Phenothiazine-2-acetic acid
The XLogP value of 3.6 indicates that Phenothiazine-2-acetic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Phenothiazine-2-acetic acid. Following Lipinski's Rule of Five, Phenothiazine-2-acetic 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 Phenothiazine-2-acetic acid?
The CAS number of Phenothiazine-2-acetic acid is 20965-69-9.
What is the molecular formula of Phenothiazine-2-acetic acid?
The molecular formula of Phenothiazine-2-acetic acid is C14H11NO2S.
What is the molecular weight of Phenothiazine-2-acetic acid?
The molecular weight of Phenothiazine-2-acetic acid is 257.05 g/mol.
Where can I buy Phenothiazine-2-acetic acid?
You can request a quote for Phenothiazine-2-acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenothiazine-2-acetic acid?
Yes, KEHONG BIO provides custom synthesis services for Phenothiazine-2-acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.