![ethyl 5-carbamoyl-2-[(4-methoxy-3-nitrobenzoyl)amino]-4-methylthiophene-3-carboxylate structure](/static/products/4450/445008-70-8.webp)
ethyl 5-carbamoyl-2-[(4-methoxy-3-nitrobenzoyl)amino]-4-methylthiophene-3-carboxylate
TL;DR: ethyl 5-carbamoyl-2-[(4-methoxy-3-nitrobenzoyl)amino]-4-methylthiophene-3-carboxylate (CAS 445008-70-8) is a chemical compound with molecular formula C17H17N3O7S and molecular weight 407.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-carbamoyl-2-[(4-methoxy-3-nitrobenzoyl)amino]-4-methylthiophene-3-carboxylate
Also Known As: ethyl 5-carbamoyl-2-[(4-methoxy-3-nitrobenzoyl)amino]-4-methylthiophene-3-carboxylate, ethyl 5-(aminocarbonyl)-2-({3-nitro-4-methoxybenzoyl}amino)-4-methyl-3-thiophenecarboxylate, ethyl 5-carbamoyl-2-[(4-methoxy-3-nitrophenyl)carbonylamino]-4-methylthiophene -3-carboxylate, ethyl 5-carbamoyl-2-{[(4-methoxy-3-nitrophenyl)carbonyl]amino}-4-methylthiophene-3-carboxylate
| Molecular Formula | C17H17N3O7S |
|---|---|
| Molecular Weight | 407.08 g/mol |
| LogP | 2.50122 |
| Topological Polar Surface Area | 150.86 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 407.07874 |
| Heavy Atoms | 28 |
| Complexity | 967.9009 |
Chemical Identifiers
| CAS Number | 445008-70-8 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC(=C1C)C(=O)N)NC(=O)C2=CC(=C(C=C2)OC)[N+](=O)[O-] |
Product Overview
ethyl 5-carbamoyl-2-[(4-methoxy-3-nitrobenzoyl)amino]-4-methylthiophene-3-carboxylate (CAS 445008-70-8), with molecular formula C17H17N3O7S and molecular weight 407.08 g/mol. IUPAC: ethyl 5-carbamoyl-2-[(4-methoxy-3-nitrobenzoyl)amino]-4-methylthiophene-3-carboxylate.
Chemical Property Profile of ethyl 5-carbamoyl-2-[(4-methoxy-3-nitrobenzoyl)amino]-4-methylthiophene-3-carboxylate
Property Insights of ethyl 5-carbamoyl-2-[(4-methoxy-3-nitrobenzoyl)amino]-4-methylthiophene-3-carboxylate
The XLogP value of 2.50122 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 5-carbamoyl-2-[(4-methoxy-3-nitrobenzoyl)amino]-4-methylthiophene-3-carboxylate. The TPSA of 150.86 Ų indicates high polarity, suggesting ethyl 5-carbamoyl-2-[(4-methoxy-3-nitrobenzoyl)amino]-4-methylthiophene-3-carboxylate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, ethyl 5-carbamoyl-2-[(4-methoxy-3-nitrobenzoyl)amino]-4-methylthiophene-3-carboxylate has 2 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 5-carbamoyl-2-[(4-methoxy-3-nitrobenzoyl)amino]-4-methylthiophene-3-carboxylate?
The CAS number of ethyl 5-carbamoyl-2-[(4-methoxy-3-nitrobenzoyl)amino]-4-methylthiophene-3-carboxylate is 445008-70-8.
What is the molecular formula of ethyl 5-carbamoyl-2-[(4-methoxy-3-nitrobenzoyl)amino]-4-methylthiophene-3-carboxylate?
The molecular formula of ethyl 5-carbamoyl-2-[(4-methoxy-3-nitrobenzoyl)amino]-4-methylthiophene-3-carboxylate is C17H17N3O7S.
What is the molecular weight of ethyl 5-carbamoyl-2-[(4-methoxy-3-nitrobenzoyl)amino]-4-methylthiophene-3-carboxylate?
The molecular weight of ethyl 5-carbamoyl-2-[(4-methoxy-3-nitrobenzoyl)amino]-4-methylthiophene-3-carboxylate is 407.08 g/mol.
Where can I buy ethyl 5-carbamoyl-2-[(4-methoxy-3-nitrobenzoyl)amino]-4-methylthiophene-3-carboxylate?
You can request a quote for ethyl 5-carbamoyl-2-[(4-methoxy-3-nitrobenzoyl)amino]-4-methylthiophene-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 5-carbamoyl-2-[(4-methoxy-3-nitrobenzoyl)amino]-4-methylthiophene-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 5-carbamoyl-2-[(4-methoxy-3-nitrobenzoyl)amino]-4-methylthiophene-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.