Sematilide
TL;DR: Sematilide (CAS 101526-83-4) is a chemical compound with molecular formula C14H23N3O3S and molecular weight 313.15 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
Also Known As: Sematilide, sematilida, sematilidum, Sematilide [INN], SEMATILIDE [MI]
| Molecular Formula | C14H23N3O3S |
|---|---|
| Molecular Weight | 313.15 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 86.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 313.14603 |
| Heavy Atoms | 21 |
| Complexity | 408.0 |
Chemical Identifiers
| CAS Number | 101526-83-4 |
|---|---|
| SMILES | CCN(CC)CCNC(=O)C1=CC=C(C=C1)NS(=O)(=O)C |
| InChIKey | KHYPYQZQJSBPIX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Sematilide (CAS 101526-83-4), with molecular formula C14H23N3O3S and molecular weight 313.15 g/mol. IUPAC: N-[2-(diethylamino)ethyl]-4-(methanesulfonamido)benzamide.
Chemical Property Profile of Sematilide
Property Insights of Sematilide
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Sematilide. The TPSA of 86.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Sematilide. Following Lipinski's Rule of Five, Sematilide 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 Sematilide?
The CAS number of Sematilide is 101526-83-4.
What is the molecular formula of Sematilide?
The molecular formula of Sematilide is C14H23N3O3S.
What is the molecular weight of Sematilide?
The molecular weight of Sematilide is 313.15 g/mol.
Where can I buy Sematilide?
You can request a quote for Sematilide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Sematilide?
Yes, KEHONG BIO provides custom synthesis services for Sematilide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.