5-chloro-N-(4-methyl-3-nitrophenyl)thiophene-2-carboxamide
TL;DR: 5-chloro-N-(4-methyl-3-nitrophenyl)thiophene-2-carboxamide (CAS 445008-67-3) is a chemical compound with molecular formula C12H9ClN2O3S and molecular weight 296.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-N-(4-methyl-3-nitrophenyl)thiophene-2-carboxamide
Also Known As: 5-chloro-N-(4-methyl-3-nitrophenyl)thiophene-2-carboxamide, 5-chloro-N-{3-nitro-4-methylphenyl}-2-thiophenecarboxamide, (5-chloro(2-thienyl))-N-(4-methyl-3-nitrophenyl)carboxamide
| Molecular Formula | C12H9ClN2O3S |
|---|---|
| Molecular Weight | 296.00 g/mol |
| LogP | 3.87042 |
| Topological Polar Surface Area | 72.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 296.00223 |
| Heavy Atoms | 19 |
| Complexity | 654.1741 |
Chemical Identifiers
| CAS Number | 445008-67-3 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)NC(=O)C2=CC=C(S2)Cl)[N+](=O)[O-] |
Product Overview
5-chloro-N-(4-methyl-3-nitrophenyl)thiophene-2-carboxamide (CAS 445008-67-3), with molecular formula C12H9ClN2O3S and molecular weight 296.00 g/mol. IUPAC: 5-chloro-N-(4-methyl-3-nitrophenyl)thiophene-2-carboxamide.
Chemical Property Profile of 5-chloro-N-(4-methyl-3-nitrophenyl)thiophene-2-carboxamide
Property Insights of 5-chloro-N-(4-methyl-3-nitrophenyl)thiophene-2-carboxamide
The XLogP value of 3.87042 indicates that 5-chloro-N-(4-methyl-3-nitrophenyl)thiophene-2-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.24 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-chloro-N-(4-methyl-3-nitrophenyl)thiophene-2-carboxamide. Following Lipinski's Rule of Five, 5-chloro-N-(4-methyl-3-nitrophenyl)thiophene-2-carboxamide has 1 hydrogen bond donor(s) and 4 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 5-chloro-N-(4-methyl-3-nitrophenyl)thiophene-2-carboxamide?
The CAS number of 5-chloro-N-(4-methyl-3-nitrophenyl)thiophene-2-carboxamide is 445008-67-3.
What is the molecular formula of 5-chloro-N-(4-methyl-3-nitrophenyl)thiophene-2-carboxamide?
The molecular formula of 5-chloro-N-(4-methyl-3-nitrophenyl)thiophene-2-carboxamide is C12H9ClN2O3S.
What is the molecular weight of 5-chloro-N-(4-methyl-3-nitrophenyl)thiophene-2-carboxamide?
The molecular weight of 5-chloro-N-(4-methyl-3-nitrophenyl)thiophene-2-carboxamide is 296.00 g/mol.
Where can I buy 5-chloro-N-(4-methyl-3-nitrophenyl)thiophene-2-carboxamide?
You can request a quote for 5-chloro-N-(4-methyl-3-nitrophenyl)thiophene-2-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-chloro-N-(4-methyl-3-nitrophenyl)thiophene-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 5-chloro-N-(4-methyl-3-nitrophenyl)thiophene-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.