Sematilide Hydrochloride
TL;DR: Sematilide Hydrochloride (CAS 101526-62-9) is a chemical compound with molecular formula C14H24ClN3O3S and molecular weight 349.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(diethylamino)ethyl]-4-(methanesulfonamido)benzamide;hydrochloride
Also Known As: SEMATILIDE HYDROCHLORIDE, Sematilide, Sematilide monohydrochloride, Sematilide HCl, Sematilide (hydrochloride)
| Molecular Formula | C14H24ClN3O3S |
|---|---|
| Molecular Weight | 349.12 g/mol |
| LogP | 1.55 |
| Topological Polar Surface Area | 86.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 349.12268 |
| Heavy Atoms | 22 |
| Complexity | 408.0 |
Chemical Identifiers
| CAS Number | 101526-62-9 |
|---|---|
| SMILES | CCN(CC)CCNC(=O)C1=CC=C(C=C1)NS(=O)(=O)C.Cl |
| InChIKey | OKXAJGDKHKNFAX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Sematilide Hydrochloride (CAS 101526-62-9), with molecular formula C14H24ClN3O3S and molecular weight 349.12 g/mol. IUPAC: N-[2-(diethylamino)ethyl]-4-(methanesulfonamido)benzamide;hydrochloride.
Chemical Property Profile of Sematilide Hydrochloride
Property Insights of Sematilide Hydrochloride
The XLogP value of 1.55 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Sematilide Hydrochloride. The TPSA of 86.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Sematilide Hydrochloride. Following Lipinski's Rule of Five, Sematilide Hydrochloride has 3 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 Sematilide Hydrochloride?
The CAS number of Sematilide Hydrochloride is 101526-62-9.
What is the molecular formula of Sematilide Hydrochloride?
The molecular formula of Sematilide Hydrochloride is C14H24ClN3O3S.
What is the molecular weight of Sematilide Hydrochloride?
The molecular weight of Sematilide Hydrochloride is 349.12 g/mol.
Where can I buy Sematilide Hydrochloride?
You can request a quote for Sematilide Hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Sematilide Hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Sematilide Hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.