3-Chlorophenothiazine
TL;DR: 3-Chlorophenothiazine (CAS 1207-99-4) is a chemical compound with molecular formula C12H8ClNS and molecular weight 233.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-10H-phenothiazine
Also Known As: 3-Chloro-10H-phenothiazine, 3-Chlorophenothiazine, 10H-Phenothiazine, 3-chloro-, 3-Chlorphenothiazin, 3-Chlorophenothiazin
| Molecular Formula | C12H8ClNS |
|---|---|
| Molecular Weight | 233.01 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 233.00659 |
| Heavy Atoms | 15 |
| Complexity | 236.0 |
Chemical Identifiers
| CAS Number | 1207-99-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)NC3=C(S2)C=C(C=C3)Cl |
| InChIKey | DPUVPRWTWNQSOS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Chlorophenothiazine (CAS 1207-99-4), with molecular formula C12H8ClNS and molecular weight 233.01 g/mol. IUPAC: 3-chloro-10H-phenothiazine.
Chemical Property Profile of 3-Chlorophenothiazine
Property Insights of 3-Chlorophenothiazine
The XLogP value of 4.8 indicates that 3-Chlorophenothiazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 3-Chlorophenothiazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Chlorophenothiazine has 1 hydrogen bond donor(s) and 2 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 3-Chlorophenothiazine?
The CAS number of 3-Chlorophenothiazine is 1207-99-4.
What is the molecular formula of 3-Chlorophenothiazine?
The molecular formula of 3-Chlorophenothiazine is C12H8ClNS.
What is the molecular weight of 3-Chlorophenothiazine?
The molecular weight of 3-Chlorophenothiazine is 233.01 g/mol.
Where can I buy 3-Chlorophenothiazine?
You can request a quote for 3-Chlorophenothiazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Chlorophenothiazine?
Yes, KEHONG BIO provides custom synthesis services for 3-Chlorophenothiazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.