AN-329/11991081
TL;DR: AN-329/11991081 (CAS 355384-30-4) is a chemical compound with molecular formula C19H19Cl2NO4S and molecular weight 427.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[2-(2,4-dichlorophenoxy)propanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Also Known As: AN-329/11991081, methyl 2-{[2-(2,4-dichlorophenoxy)propanoyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, A2623/0111619, METHYL 2-[2-(2,4-DICHLOROPHENOXY)PROPANAMIDO]-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-3-CARBOXYLATE, methyl 2-[2-(2,4-dichlorophenoxy)propanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
| Molecular Formula | C19H19Cl2NO4S |
|---|---|
| Molecular Weight | 427.04 g/mol |
| LogP | 5.1263 |
| Topological Polar Surface Area | 64.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 427.0412 |
| Heavy Atoms | 27 |
| Complexity | 880.8349 |
Chemical Identifiers
| CAS Number | 355384-30-4 |
|---|---|
| SMILES | CC(C(=O)NC1=C(C2=C(S1)CCCC2)C(=O)OC)OC3=C(C=C(C=C3)Cl)Cl |
Product Overview
AN-329/11991081 (CAS 355384-30-4), with molecular formula C19H19Cl2NO4S and molecular weight 427.04 g/mol. IUPAC: methyl 2-[2-(2,4-dichlorophenoxy)propanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate.
Chemical Property Profile of AN-329/11991081
Property Insights of AN-329/11991081
The XLogP value of 5.1263 indicates that AN-329/11991081 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.63 Ų falls within the moderate polarity range, balancing permeability and solubility for AN-329/11991081. Following Lipinski's Rule of Five, AN-329/11991081 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AN-329/11991081?
The CAS number of AN-329/11991081 is 355384-30-4.
What is the molecular formula of AN-329/11991081?
The molecular formula of AN-329/11991081 is C19H19Cl2NO4S.
What is the molecular weight of AN-329/11991081?
The molecular weight of AN-329/11991081 is 427.04 g/mol.
Where can I buy AN-329/11991081?
You can request a quote for AN-329/11991081 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-329/11991081?
Yes, KEHONG BIO provides custom synthesis services for AN-329/11991081 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.