Aclantate
TL;DR: Aclantate (CAS 39633-62-0) is a chemical compound with molecular formula C15H14ClNO4S and molecular weight 339.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
acetyloxymethyl 4-(2-chloro-3-methylanilino)thiophene-3-carboxylate
Also Known As: Aclantate, Aclantatum, Aclantato, Aclantate [INN], Hoe 473
| Molecular Formula | C15H14ClNO4S |
|---|---|
| Molecular Weight | 339.03 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 92.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 339.0332 |
| Heavy Atoms | 22 |
| Complexity | 409.0 |
Chemical Identifiers
| CAS Number | 39633-62-0 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)NC2=CSC=C2C(=O)OCOC(=O)C)Cl |
| InChIKey | KMGLZXXYCVKWOP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Aclantate (CAS 39633-62-0), with molecular formula C15H14ClNO4S and molecular weight 339.03 g/mol. IUPAC: acetyloxymethyl 4-(2-chloro-3-methylanilino)thiophene-3-carboxylate.
Chemical Property Profile of Aclantate
Property Insights of Aclantate
The XLogP value of 4.5 indicates that Aclantate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Aclantate. Following Lipinski's Rule of Five, Aclantate has 1 hydrogen bond donor(s) and 6 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 Aclantate?
The CAS number of Aclantate is 39633-62-0.
What is the molecular formula of Aclantate?
The molecular formula of Aclantate is C15H14ClNO4S.
What is the molecular weight of Aclantate?
The molecular weight of Aclantate is 339.03 g/mol.
Where can I buy Aclantate?
You can request a quote for Aclantate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Aclantate?
Yes, KEHONG BIO provides custom synthesis services for Aclantate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.