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Ethyl 2-[(3-nitrophenyl)carbonylamino]-5-propylthiophene-3-carboxylate
TL;DR: Ethyl 2-[(3-nitrophenyl)carbonylamino]-5-propylthiophene-3-carboxylate (CAS 6308-63-0) is a chemical compound with molecular formula C17H18N2O5S and molecular weight 362.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[(3-nitrobenzoyl)amino]-5-propylthiophene-3-carboxylate
Also Known As: Ethyl, ethyl 2-[(3-nitrobenzoyl)amino]-5-propyl-3-thiophenecarboxylate, ethyl 2-[(3-nitrophenyl)carbonylamino]-5-propylthiophene-3-carboxylate, ethyl 2-{[(3-nitrophenyl)carbonyl]amino}-5-propylthiophene-3-carboxylate
| Molecular Formula | C17H18N2O5S |
|---|---|
| Molecular Weight | 362.09 g/mol |
| LogP | 4.0378 |
| Topological Polar Surface Area | 98.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 362.09363 |
| Heavy Atoms | 25 |
| Complexity | 800.08594 |
Chemical Identifiers
| CAS Number | 6308-63-0 |
|---|---|
| SMILES | CCCC1=CC(=C(S1)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OCC |
Product Overview
Ethyl 2-[(3-nitrophenyl)carbonylamino]-5-propylthiophene-3-carboxylate (CAS 6308-63-0), with molecular formula C17H18N2O5S and molecular weight 362.09 g/mol. IUPAC: ethyl 2-[(3-nitrobenzoyl)amino]-5-propylthiophene-3-carboxylate.
Chemical Property Profile of Ethyl 2-[(3-nitrophenyl)carbonylamino]-5-propylthiophene-3-carboxylate
Property Insights of Ethyl 2-[(3-nitrophenyl)carbonylamino]-5-propylthiophene-3-carboxylate
The XLogP value of 4.0378 indicates that Ethyl 2-[(3-nitrophenyl)carbonylamino]-5-propylthiophene-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.54 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-[(3-nitrophenyl)carbonylamino]-5-propylthiophene-3-carboxylate. Following Lipinski's Rule of Five, Ethyl 2-[(3-nitrophenyl)carbonylamino]-5-propylthiophene-3-carboxylate 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 2-[(3-nitrophenyl)carbonylamino]-5-propylthiophene-3-carboxylate?
The CAS number of Ethyl 2-[(3-nitrophenyl)carbonylamino]-5-propylthiophene-3-carboxylate is 6308-63-0.
What is the molecular formula of Ethyl 2-[(3-nitrophenyl)carbonylamino]-5-propylthiophene-3-carboxylate?
The molecular formula of Ethyl 2-[(3-nitrophenyl)carbonylamino]-5-propylthiophene-3-carboxylate is C17H18N2O5S.
What is the molecular weight of Ethyl 2-[(3-nitrophenyl)carbonylamino]-5-propylthiophene-3-carboxylate?
The molecular weight of Ethyl 2-[(3-nitrophenyl)carbonylamino]-5-propylthiophene-3-carboxylate is 362.09 g/mol.
Where can I buy Ethyl 2-[(3-nitrophenyl)carbonylamino]-5-propylthiophene-3-carboxylate?
You can request a quote for Ethyl 2-[(3-nitrophenyl)carbonylamino]-5-propylthiophene-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-[(3-nitrophenyl)carbonylamino]-5-propylthiophene-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-[(3-nitrophenyl)carbonylamino]-5-propylthiophene-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.