Hycanthone sulfamate
TL;DR: Hycanthone sulfamate (CAS 23282-51-1) is a chemical compound with molecular formula C20H27N3O5S2 and molecular weight 453.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-(diethylamino)ethylamino]-4-(hydroxymethyl)thioxanthen-9-one;sulfamic acid
Also Known As: HYCANTHONE SULFAMATE, 1-((2-(Diethylamino)ethyl)amino)-4-(hydroxymethyl)thioxanthen-9-one sulfamate, 1-(2-Diethylaminoethylamino)-4-(hydroxymethyl)thioxanthen-9-one;sulfamic acid, Sulfamic acid, compd. with 1-((2-(diethylamino)ethyl)amino)-4-(hydroxymethyl)-9H-thioxanthen-9-one (1:1), 1-[2-(diethylamino)ethylamino]-4-(hydroxymethyl)thioxanthen-9-one;sulfamic acid
| Molecular Formula | C20H27N3O5S2 |
|---|---|
| Molecular Weight | 453.14 g/mol |
| LogP | 2.41 |
| Topological Polar Surface Area | 167.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 7 |
| Exact Mass | 453.13922 |
| Heavy Atoms | 30 |
| Complexity | 536.0 |
Chemical Identifiers
| CAS Number | 23282-51-1 |
|---|---|
| SMILES | CCN(CC)CCNC1=C2C(=C(C=C1)CO)SC3=CC=CC=C3C2=O.NS(=O)(=O)O |
| InChIKey | XKXSMHTUJNQUOW-UHFFFAOYSA-N |
Product Overview
Hycanthone sulfamate (CAS 23282-51-1), with molecular formula C20H27N3O5S2 and molecular weight 453.14 g/mol. IUPAC: 1-[2-(diethylamino)ethylamino]-4-(hydroxymethyl)thioxanthen-9-one;sulfamic acid.
Chemical Property Profile of Hycanthone sulfamate
Property Insights of Hycanthone sulfamate
The XLogP value of 2.41 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hycanthone sulfamate. The TPSA of 167.0 Ų indicates high polarity, suggesting Hycanthone sulfamate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Hycanthone sulfamate has 4 hydrogen bond donor(s) and 9 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 Hycanthone sulfamate?
The CAS number of Hycanthone sulfamate is 23282-51-1.
What is the molecular formula of Hycanthone sulfamate?
The molecular formula of Hycanthone sulfamate is C20H27N3O5S2.
What is the molecular weight of Hycanthone sulfamate?
The molecular weight of Hycanthone sulfamate is 453.14 g/mol.
Where can I buy Hycanthone sulfamate?
You can request a quote for Hycanthone sulfamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hycanthone sulfamate?
Yes, KEHONG BIO provides custom synthesis services for Hycanthone sulfamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.