![ethyl 5-[(diethylamino)carbonyl]-2-[(3-isopropoxybenzoyl)amino]-4-methyl-3-thiophenecarboxylate structure](/static/products/4452/445239-04-3.webp)
ethyl 5-[(diethylamino)carbonyl]-2-[(3-isopropoxybenzoyl)amino]-4-methyl-3-thiophenecarboxylate
TL;DR: ethyl 5-[(diethylamino)carbonyl]-2-[(3-isopropoxybenzoyl)amino]-4-methyl-3-thiophenecarboxylate (CAS 445239-04-3) is a chemical compound with molecular formula C23H30N2O5S and molecular weight 446.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-(diethylcarbamoyl)-4-methyl-2-[(3-propan-2-yloxybenzoyl)amino]thiophene-3-carboxylate
Also Known As: ethyl 5-[(diethylamino)carbonyl]-2-[(3-isopropoxybenzoyl)amino]-4-methyl-3-thiophenecarboxylate, ethyl 5-(diethylcarbamoyl)-4-methyl-2-[(3-propan-2-yloxybenzoyl)amino]thiophene-3-carboxylate, ethyl 5-(diethylcarbamoyl)-4-methyl-2-({[3-(propan-2-yloxy)phenyl]carbonyl}amino)thiophene-3-carboxylate, ethyl 5-(N,N-diethylcarbamoyl)-4-methyl-2-{[3-(methylethoxy)phenyl]carbonylami no}thiophene-3-carboxylate
| Molecular Formula | C23H30N2O5S |
|---|---|
| Molecular Weight | 446.19 g/mol |
| LogP | 4.75472 |
| Topological Polar Surface Area | 84.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 446.18753 |
| Heavy Atoms | 31 |
| Complexity | 947.43866 |
Chemical Identifiers
| CAS Number | 445239-04-3 |
|---|---|
| SMILES | CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)C2=CC(=CC=C2)OC(C)C)C(=O)OCC)C |
Product Overview
ethyl 5-[(diethylamino)carbonyl]-2-[(3-isopropoxybenzoyl)amino]-4-methyl-3-thiophenecarboxylate (CAS 445239-04-3), with molecular formula C23H30N2O5S and molecular weight 446.19 g/mol. IUPAC: ethyl 5-(diethylcarbamoyl)-4-methyl-2-[(3-propan-2-yloxybenzoyl)amino]thiophene-3-carboxylate.
Chemical Property Profile of ethyl 5-[(diethylamino)carbonyl]-2-[(3-isopropoxybenzoyl)amino]-4-methyl-3-thiophenecarboxylate
Property Insights of ethyl 5-[(diethylamino)carbonyl]-2-[(3-isopropoxybenzoyl)amino]-4-methyl-3-thiophenecarboxylate
The XLogP value of 4.75472 indicates that ethyl 5-[(diethylamino)carbonyl]-2-[(3-isopropoxybenzoyl)amino]-4-methyl-3-thiophenecarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.94 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 5-[(diethylamino)carbonyl]-2-[(3-isopropoxybenzoyl)amino]-4-methyl-3-thiophenecarboxylate. Following Lipinski's Rule of Five, ethyl 5-[(diethylamino)carbonyl]-2-[(3-isopropoxybenzoyl)amino]-4-methyl-3-thiophenecarboxylate 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 ethyl 5-[(diethylamino)carbonyl]-2-[(3-isopropoxybenzoyl)amino]-4-methyl-3-thiophenecarboxylate?
The CAS number of ethyl 5-[(diethylamino)carbonyl]-2-[(3-isopropoxybenzoyl)amino]-4-methyl-3-thiophenecarboxylate is 445239-04-3.
What is the molecular formula of ethyl 5-[(diethylamino)carbonyl]-2-[(3-isopropoxybenzoyl)amino]-4-methyl-3-thiophenecarboxylate?
The molecular formula of ethyl 5-[(diethylamino)carbonyl]-2-[(3-isopropoxybenzoyl)amino]-4-methyl-3-thiophenecarboxylate is C23H30N2O5S.
What is the molecular weight of ethyl 5-[(diethylamino)carbonyl]-2-[(3-isopropoxybenzoyl)amino]-4-methyl-3-thiophenecarboxylate?
The molecular weight of ethyl 5-[(diethylamino)carbonyl]-2-[(3-isopropoxybenzoyl)amino]-4-methyl-3-thiophenecarboxylate is 446.19 g/mol.
Where can I buy ethyl 5-[(diethylamino)carbonyl]-2-[(3-isopropoxybenzoyl)amino]-4-methyl-3-thiophenecarboxylate?
You can request a quote for ethyl 5-[(diethylamino)carbonyl]-2-[(3-isopropoxybenzoyl)amino]-4-methyl-3-thiophenecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 5-[(diethylamino)carbonyl]-2-[(3-isopropoxybenzoyl)amino]-4-methyl-3-thiophenecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 5-[(diethylamino)carbonyl]-2-[(3-isopropoxybenzoyl)amino]-4-methyl-3-thiophenecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.