Phenothiazone
TL;DR: Phenothiazone (CAS 581-30-6) is a chemical compound with molecular formula C12H7NOS and molecular weight 213.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
phenothiazin-3-one
Also Known As: 3H-Phenothiazin-3-one, 3-Phenothiazone, Phenothiazone, phenothiazin-3-one, 3H-Phenothiazine-3-one
| Molecular Formula | C12H7NOS |
|---|---|
| Molecular Weight | 213.02 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 54.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 213.02484 |
| Heavy Atoms | 15 |
| Complexity | 394.0 |
Chemical Identifiers
| CAS Number | 581-30-6 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C3C=CC(=O)C=C3S2 |
| InChIKey | YKGCCFHSXQHWIG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Phenothiazone (CAS 581-30-6), with molecular formula C12H7NOS and molecular weight 213.02 g/mol. IUPAC: phenothiazin-3-one.
Chemical Property Profile of Phenothiazone
Property Insights of Phenothiazone
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phenothiazone. With a topological polar surface area (TPSA) of 54.7 Ų, Phenothiazone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenothiazone has 0 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 Phenothiazone?
The CAS number of Phenothiazone is 581-30-6.
What is the molecular formula of Phenothiazone?
The molecular formula of Phenothiazone is C12H7NOS.
What is the molecular weight of Phenothiazone?
The molecular weight of Phenothiazone is 213.02 g/mol.
Where can I buy Phenothiazone?
You can request a quote for Phenothiazone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenothiazone?
Yes, KEHONG BIO provides custom synthesis services for Phenothiazone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.