![[4-(Diethylamino)anilino]methanesulfonic acid structure](/static/products/3238/32387-68-1.webp)
[4-(Diethylamino)anilino]methanesulfonic acid
TL;DR: [4-(Diethylamino)anilino]methanesulfonic acid (CAS 32387-68-1) is a chemical compound with molecular formula C11H18N2O3S and molecular weight 258.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(diethylamino)anilino]methanesulfonic acid
Also Known As: 4-Sulfomethylamino-N,N-diethylaniline, [4-(diethylamino)anilino]methanesulfonic acid, 4-(Diethylamino)anilinomethanesulfonic acid, {[4-(diethylamino)phenyl]amino}methanesulfonic acid, 1-[[4-(Diethylamino)phenyl]amino]methanesulfonic acid
| Molecular Formula | C11H18N2O3S |
|---|---|
| Molecular Weight | 258.10 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 78.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 258.10382 |
| Heavy Atoms | 17 |
| Complexity | 301.0 |
Chemical Identifiers
| CAS Number | 32387-68-1 |
|---|---|
| SMILES | CCN(CC)C1=CC=C(C=C1)NCS(=O)(=O)O |
| InChIKey | HCDZJHXTPVPZCS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
[4-(Diethylamino)anilino]methanesulfonic acid (CAS 32387-68-1), with molecular formula C11H18N2O3S and molecular weight 258.10 g/mol. IUPAC: [4-(diethylamino)anilino]methanesulfonic acid.
Chemical Property Profile of [4-(Diethylamino)anilino]methanesulfonic acid
Property Insights of [4-(Diethylamino)anilino]methanesulfonic acid
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [4-(Diethylamino)anilino]methanesulfonic acid. The TPSA of 78.0 Ų falls within the moderate polarity range, balancing permeability and solubility for [4-(Diethylamino)anilino]methanesulfonic acid. Following Lipinski's Rule of Five, [4-(Diethylamino)anilino]methanesulfonic acid has 2 hydrogen bond donor(s) and 5 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 [4-(Diethylamino)anilino]methanesulfonic acid?
The CAS number of [4-(Diethylamino)anilino]methanesulfonic acid is 32387-68-1.
What is the molecular formula of [4-(Diethylamino)anilino]methanesulfonic acid?
The molecular formula of [4-(Diethylamino)anilino]methanesulfonic acid is C11H18N2O3S.
What is the molecular weight of [4-(Diethylamino)anilino]methanesulfonic acid?
The molecular weight of [4-(Diethylamino)anilino]methanesulfonic acid is 258.10 g/mol.
Where can I buy [4-(Diethylamino)anilino]methanesulfonic acid?
You can request a quote for [4-(Diethylamino)anilino]methanesulfonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [4-(Diethylamino)anilino]methanesulfonic acid?
Yes, KEHONG BIO provides custom synthesis services for [4-(Diethylamino)anilino]methanesulfonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.