dimethyl 5-(4-(4-methoxyphenyl)butanamido)-3-methylthiophene-2,4-dicarboxylate
TL;DR: dimethyl 5-(4-(4-methoxyphenyl)butanamido)-3-methylthiophene-2,4-dicarboxylate (CAS 840470-38-4) is a chemical compound with molecular formula C20H23NO6S and molecular weight 405.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 5-[4-(4-methoxyphenyl)butanoylamino]-3-methylthiophene-2,4-dicarboxylate
Also Known As: dimethyl 5-(4-(4-methoxyphenyl)butanamido)-3-methylthiophene-2,4-dicarboxylate, dimethyl 5-[4-(4-methoxyphenyl)butanoylamino]-3-methylthiophene-2,4-dicarboxylate, dimethyl 5-{[4-(4-methoxyphenyl)butanoyl]amino}-3-methylthiophene-2,4-dicarboxylate
| Molecular Formula | C20H23NO6S |
|---|---|
| Molecular Weight | 405.12 g/mol |
| LogP | 3.59972 |
| Topological Polar Surface Area | 90.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 405.1246 |
| Heavy Atoms | 28 |
| Complexity | 856.32605 |
Chemical Identifiers
| CAS Number | 840470-38-4 |
|---|---|
| SMILES | CC1=C(SC(=C1C(=O)OC)NC(=O)CCCC2=CC=C(C=C2)OC)C(=O)OC |
Product Overview
dimethyl 5-(4-(4-methoxyphenyl)butanamido)-3-methylthiophene-2,4-dicarboxylate (CAS 840470-38-4), with molecular formula C20H23NO6S and molecular weight 405.12 g/mol. IUPAC: dimethyl 5-[4-(4-methoxyphenyl)butanoylamino]-3-methylthiophene-2,4-dicarboxylate.
Chemical Property Profile of dimethyl 5-(4-(4-methoxyphenyl)butanamido)-3-methylthiophene-2,4-dicarboxylate
Property Insights of dimethyl 5-(4-(4-methoxyphenyl)butanamido)-3-methylthiophene-2,4-dicarboxylate
The XLogP value of 3.59972 indicates that dimethyl 5-(4-(4-methoxyphenyl)butanamido)-3-methylthiophene-2,4-dicarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.93 Ų falls within the moderate polarity range, balancing permeability and solubility for dimethyl 5-(4-(4-methoxyphenyl)butanamido)-3-methylthiophene-2,4-dicarboxylate. Following Lipinski's Rule of Five, dimethyl 5-(4-(4-methoxyphenyl)butanamido)-3-methylthiophene-2,4-dicarboxylate has 1 hydrogen bond donor(s) and 7 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 dimethyl 5-(4-(4-methoxyphenyl)butanamido)-3-methylthiophene-2,4-dicarboxylate?
The CAS number of dimethyl 5-(4-(4-methoxyphenyl)butanamido)-3-methylthiophene-2,4-dicarboxylate is 840470-38-4.
What is the molecular formula of dimethyl 5-(4-(4-methoxyphenyl)butanamido)-3-methylthiophene-2,4-dicarboxylate?
The molecular formula of dimethyl 5-(4-(4-methoxyphenyl)butanamido)-3-methylthiophene-2,4-dicarboxylate is C20H23NO6S.
What is the molecular weight of dimethyl 5-(4-(4-methoxyphenyl)butanamido)-3-methylthiophene-2,4-dicarboxylate?
The molecular weight of dimethyl 5-(4-(4-methoxyphenyl)butanamido)-3-methylthiophene-2,4-dicarboxylate is 405.12 g/mol.
Where can I buy dimethyl 5-(4-(4-methoxyphenyl)butanamido)-3-methylthiophene-2,4-dicarboxylate?
You can request a quote for dimethyl 5-(4-(4-methoxyphenyl)butanamido)-3-methylthiophene-2,4-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for dimethyl 5-(4-(4-methoxyphenyl)butanamido)-3-methylthiophene-2,4-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for dimethyl 5-(4-(4-methoxyphenyl)butanamido)-3-methylthiophene-2,4-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.