Propyl 4-(4-bromophenyl)-2-[(pyridin-3-ylcarbonyl)amino]thiophene-3-carboxylate
TL;DR: Propyl 4-(4-bromophenyl)-2-[(pyridin-3-ylcarbonyl)amino]thiophene-3-carboxylate (CAS 445007-22-7) is a chemical compound with molecular formula C20H17BrN2O3S and molecular weight 444.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propyl 4-(4-bromophenyl)-2-(pyridine-3-carbonylamino)thiophene-3-carboxylate
Also Known As: propyl 4-(4-bromophenyl)-2-[(pyridin-3-ylcarbonyl)amino]thiophene-3-carboxylate, propyl 4-(4-bromophenyl)-2-(pyridine-3-carbonylamino)thiophene-3-carboxylate, propyl 4-(4-bromophenyl)-2-(nicotinamido)thiophene-3-carboxylate, propyl 4-(4-bromophenyl)-2-(3-pyridylcarbonylamino)thiophene-3-carboxylate, PROPYL 4-(4-BROMOPHENYL)-2-(PYRIDINE-3-AMIDO)THIOPHENE-3-CARBOXYLATE
| Molecular Formula | C20H17BrN2O3S |
|---|---|
| Molecular Weight | 444.01 g/mol |
| LogP | 5.3917 |
| Topological Polar Surface Area | 68.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 444.01434 |
| Heavy Atoms | 27 |
| Complexity | 939.6205 |
Chemical Identifiers
| CAS Number | 445007-22-7 |
|---|---|
| SMILES | CCCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)Br)NC(=O)C3=CN=CC=C3 |
Product Overview
Propyl 4-(4-bromophenyl)-2-[(pyridin-3-ylcarbonyl)amino]thiophene-3-carboxylate (CAS 445007-22-7), with molecular formula C20H17BrN2O3S and molecular weight 444.01 g/mol. IUPAC: propyl 4-(4-bromophenyl)-2-(pyridine-3-carbonylamino)thiophene-3-carboxylate.
Chemical Property Profile of Propyl 4-(4-bromophenyl)-2-[(pyridin-3-ylcarbonyl)amino]thiophene-3-carboxylate
Property Insights of Propyl 4-(4-bromophenyl)-2-[(pyridin-3-ylcarbonyl)amino]thiophene-3-carboxylate
The XLogP value of 5.3917 indicates that Propyl 4-(4-bromophenyl)-2-[(pyridin-3-ylcarbonyl)amino]thiophene-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.29 Ų falls within the moderate polarity range, balancing permeability and solubility for Propyl 4-(4-bromophenyl)-2-[(pyridin-3-ylcarbonyl)amino]thiophene-3-carboxylate. Following Lipinski's Rule of Five, Propyl 4-(4-bromophenyl)-2-[(pyridin-3-ylcarbonyl)amino]thiophene-3-carboxylate has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Propyl 4-(4-bromophenyl)-2-[(pyridin-3-ylcarbonyl)amino]thiophene-3-carboxylate?
The CAS number of Propyl 4-(4-bromophenyl)-2-[(pyridin-3-ylcarbonyl)amino]thiophene-3-carboxylate is 445007-22-7.
What is the molecular formula of Propyl 4-(4-bromophenyl)-2-[(pyridin-3-ylcarbonyl)amino]thiophene-3-carboxylate?
The molecular formula of Propyl 4-(4-bromophenyl)-2-[(pyridin-3-ylcarbonyl)amino]thiophene-3-carboxylate is C20H17BrN2O3S.
What is the molecular weight of Propyl 4-(4-bromophenyl)-2-[(pyridin-3-ylcarbonyl)amino]thiophene-3-carboxylate?
The molecular weight of Propyl 4-(4-bromophenyl)-2-[(pyridin-3-ylcarbonyl)amino]thiophene-3-carboxylate is 444.01 g/mol.
Where can I buy Propyl 4-(4-bromophenyl)-2-[(pyridin-3-ylcarbonyl)amino]thiophene-3-carboxylate?
You can request a quote for Propyl 4-(4-bromophenyl)-2-[(pyridin-3-ylcarbonyl)amino]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 Propyl 4-(4-bromophenyl)-2-[(pyridin-3-ylcarbonyl)amino]thiophene-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Propyl 4-(4-bromophenyl)-2-[(pyridin-3-ylcarbonyl)amino]thiophene-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.