Dichlormezanone
TL;DR: Dichlormezanone (CAS 5571-97-1) is a chemical compound with molecular formula C11H11Cl2NO3S and molecular weight 306.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,4-dichlorophenyl)-3-methyl-1,1-dioxo-1,3-thiazinan-4-one
Also Known As: Dichlormezanone, Dichlormethazanone, Diclormezanona, Dichlormezanonum, Dichlormezanone [INN]
| Molecular Formula | C11H11Cl2NO3S |
|---|---|
| Molecular Weight | 306.98 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 62.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 306.98367 |
| Heavy Atoms | 18 |
| Complexity | 434.0 |
Chemical Identifiers
| CAS Number | 5571-97-1 |
|---|---|
| SMILES | CN1C(S(=O)(=O)CCC1=O)C2=CC(=C(C=C2)Cl)Cl |
| InChIKey | FTBWWORDOHNJDB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dichlormezanone (CAS 5571-97-1), with molecular formula C11H11Cl2NO3S and molecular weight 306.98 g/mol. IUPAC: 2-(3,4-dichlorophenyl)-3-methyl-1,1-dioxo-1,3-thiazinan-4-one.
Chemical Property Profile of Dichlormezanone
Property Insights of Dichlormezanone
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dichlormezanone. The TPSA of 62.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Dichlormezanone. Following Lipinski's Rule of Five, Dichlormezanone 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 Dichlormezanone?
The CAS number of Dichlormezanone is 5571-97-1.
What is the molecular formula of Dichlormezanone?
The molecular formula of Dichlormezanone is C11H11Cl2NO3S.
What is the molecular weight of Dichlormezanone?
The molecular weight of Dichlormezanone is 306.98 g/mol.
Where can I buy Dichlormezanone?
You can request a quote for Dichlormezanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dichlormezanone?
Yes, KEHONG BIO provides custom synthesis services for Dichlormezanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.