3-Dimethylamino-psi-saccharin
TL;DR: 3-Dimethylamino-psi-saccharin (CAS 22716-43-4) is a chemical compound with molecular formula C9H10N2O2S and molecular weight 210.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-dimethyl-1,1-dioxo-1,2-benzothiazol-3-amine
Also Known As: 3-Dimethylamino-psi-saccharin, N,N-dimethyl-1,1-dioxo-1,2-benzothiazol-3-amine, 3-DIMETHYLAMINO-.PSI.-SACCHARIN, 3-DIMETHYLAMINO-PSEUDO-SACCHARIN, 3-(dimethylamino)benzo[d]isothiazole 1,1-dioxide
| Molecular Formula | C9H10N2O2S |
|---|---|
| Molecular Weight | 210.05 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 58.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 210.0463 |
| Heavy Atoms | 14 |
| Complexity | 353.0 |
Chemical Identifiers
| CAS Number | 22716-43-4 |
|---|---|
| SMILES | CN(C)C1=NS(=O)(=O)C2=CC=CC=C21 |
| InChIKey | GTLJDAHQXYGVCG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Dimethylamino-psi-saccharin (CAS 22716-43-4), with molecular formula C9H10N2O2S and molecular weight 210.05 g/mol. IUPAC: N,N-dimethyl-1,1-dioxo-1,2-benzothiazol-3-amine.
Chemical Property Profile of 3-Dimethylamino-psi-saccharin
Property Insights of 3-Dimethylamino-psi-saccharin
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Dimethylamino-psi-saccharin. With a topological polar surface area (TPSA) of 58.1 Ų, 3-Dimethylamino-psi-saccharin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Dimethylamino-psi-saccharin 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 3-Dimethylamino-psi-saccharin?
The CAS number of 3-Dimethylamino-psi-saccharin is 22716-43-4.
What is the molecular formula of 3-Dimethylamino-psi-saccharin?
The molecular formula of 3-Dimethylamino-psi-saccharin is C9H10N2O2S.
What is the molecular weight of 3-Dimethylamino-psi-saccharin?
The molecular weight of 3-Dimethylamino-psi-saccharin is 210.05 g/mol.
Where can I buy 3-Dimethylamino-psi-saccharin?
You can request a quote for 3-Dimethylamino-psi-saccharin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Dimethylamino-psi-saccharin?
Yes, KEHONG BIO provides custom synthesis services for 3-Dimethylamino-psi-saccharin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.