ethyl 2-amino-5-(dimethylcarbamoyl)-4-({[3-(furan-2-yl)prop-2-enoyl]oxy}methyl)thiophene-3-carboxylate
TL;DR: ethyl 2-amino-5-(dimethylcarbamoyl)-4-({[3-(furan-2-yl)prop-2-enoyl]oxy}methyl)thiophene-3-carboxylate (CAS 5478-67-1) is a chemical compound with molecular formula C18H20N2O6S and molecular weight 392.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-amino-5-(dimethylcarbamoyl)-4-[3-(furan-2-yl)prop-2-enoyloxymethyl]thiophene-3-carboxylate
Also Known As: ethyl 2-amino-5-(dimethylcarbamoyl)-4-({[3-(furan-2-yl)prop-2-enoyl]oxy}methyl)thiophene-3-carboxylate, ethyl 2-amino-5-(dimethylcarbamoyl)-4-[3-(furan-2-yl)prop-2-enoyloxymethyl]thiophene-3-carboxylate
| Molecular Formula | C18H20N2O6S |
|---|---|
| Molecular Weight | 392.10 g/mol |
| LogP | 2.5584 |
| Topological Polar Surface Area | 112.07 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 392.10422 |
| Heavy Atoms | 27 |
| Complexity | 851.58374 |
Chemical Identifiers
| CAS Number | 5478-67-1 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC(=C1COC(=O)C=CC2=CC=CO2)C(=O)N(C)C)N |
Product Overview
ethyl 2-amino-5-(dimethylcarbamoyl)-4-({[3-(furan-2-yl)prop-2-enoyl]oxy}methyl)thiophene-3-carboxylate (CAS 5478-67-1), with molecular formula C18H20N2O6S and molecular weight 392.10 g/mol. IUPAC: ethyl 2-amino-5-(dimethylcarbamoyl)-4-[3-(furan-2-yl)prop-2-enoyloxymethyl]thiophene-3-carboxylate.
Chemical Property Profile of ethyl 2-amino-5-(dimethylcarbamoyl)-4-({[3-(furan-2-yl)prop-2-enoyl]oxy}methyl)thiophene-3-carboxylate
Property Insights of ethyl 2-amino-5-(dimethylcarbamoyl)-4-({[3-(furan-2-yl)prop-2-enoyl]oxy}methyl)thiophene-3-carboxylate
The XLogP value of 2.5584 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 2-amino-5-(dimethylcarbamoyl)-4-({[3-(furan-2-yl)prop-2-enoyl]oxy}methyl)thiophene-3-carboxylate. The TPSA of 112.07 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 2-amino-5-(dimethylcarbamoyl)-4-({[3-(furan-2-yl)prop-2-enoyl]oxy}methyl)thiophene-3-carboxylate. Following Lipinski's Rule of Five, ethyl 2-amino-5-(dimethylcarbamoyl)-4-({[3-(furan-2-yl)prop-2-enoyl]oxy}methyl)thiophene-3-carboxylate has 1 hydrogen bond donor(s) and 8 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 ethyl 2-amino-5-(dimethylcarbamoyl)-4-({[3-(furan-2-yl)prop-2-enoyl]oxy}methyl)thiophene-3-carboxylate?
The CAS number of ethyl 2-amino-5-(dimethylcarbamoyl)-4-({[3-(furan-2-yl)prop-2-enoyl]oxy}methyl)thiophene-3-carboxylate is 5478-67-1.
What is the molecular formula of ethyl 2-amino-5-(dimethylcarbamoyl)-4-({[3-(furan-2-yl)prop-2-enoyl]oxy}methyl)thiophene-3-carboxylate?
The molecular formula of ethyl 2-amino-5-(dimethylcarbamoyl)-4-({[3-(furan-2-yl)prop-2-enoyl]oxy}methyl)thiophene-3-carboxylate is C18H20N2O6S.
What is the molecular weight of ethyl 2-amino-5-(dimethylcarbamoyl)-4-({[3-(furan-2-yl)prop-2-enoyl]oxy}methyl)thiophene-3-carboxylate?
The molecular weight of ethyl 2-amino-5-(dimethylcarbamoyl)-4-({[3-(furan-2-yl)prop-2-enoyl]oxy}methyl)thiophene-3-carboxylate is 392.10 g/mol.
Where can I buy ethyl 2-amino-5-(dimethylcarbamoyl)-4-({[3-(furan-2-yl)prop-2-enoyl]oxy}methyl)thiophene-3-carboxylate?
You can request a quote for ethyl 2-amino-5-(dimethylcarbamoyl)-4-({[3-(furan-2-yl)prop-2-enoyl]oxy}methyl)thiophene-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 2-amino-5-(dimethylcarbamoyl)-4-({[3-(furan-2-yl)prop-2-enoyl]oxy}methyl)thiophene-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 2-amino-5-(dimethylcarbamoyl)-4-({[3-(furan-2-yl)prop-2-enoyl]oxy}methyl)thiophene-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.