Methyl 3-amino-4-(4-fluorophenyl)thiophene-2-carboxylate
TL;DR: Methyl 3-amino-4-(4-fluorophenyl)thiophene-2-carboxylate (CAS 156274-32-7) is a chemical compound with molecular formula C12H10FNO2S and molecular weight 251.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-amino-4-(4-fluorophenyl)thiophene-2-carboxylate
Also Known As: methyl 3-amino-4-(4-fluorophenyl)thiophene-2-carboxylate, methyl 3-amino-4-(4-fluorophenyl)-2-thiophenecarboxylate, METHYL3-AMINO-4-(4-FLUOROPHENYL)THIOPHENE-2-CARBOXYLATE, 3-Amino-4-(4-fluoro-phenyl)-thiophene-2-car boxylic acid methyl ester, Methyl 3-amino-4-(4-fluorophenyl)thiophene-2-carboxylate, AldrichCPR
| Molecular Formula | C12H10FNO2S |
|---|---|
| Molecular Weight | 251.04 g/mol |
| LogP | 2.923 |
| Topological Polar Surface Area | 52.32 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 251.04163 |
| Heavy Atoms | 17 |
| Complexity | 548.1333 |
Chemical Identifiers
| CAS Number | 156274-32-7 |
|---|---|
| SMILES | COC(=O)C1=C(C(=CS1)C2=CC=C(C=C2)F)N |
Product Overview
Methyl 3-amino-4-(4-fluorophenyl)thiophene-2-carboxylate (CAS 156274-32-7), with molecular formula C12H10FNO2S and molecular weight 251.04 g/mol. IUPAC: methyl 3-amino-4-(4-fluorophenyl)thiophene-2-carboxylate.
Chemical Property Profile of Methyl 3-amino-4-(4-fluorophenyl)thiophene-2-carboxylate
Property Insights of Methyl 3-amino-4-(4-fluorophenyl)thiophene-2-carboxylate
The XLogP value of 2.923 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 3-amino-4-(4-fluorophenyl)thiophene-2-carboxylate. With a topological polar surface area (TPSA) of 52.32 Ų, Methyl 3-amino-4-(4-fluorophenyl)thiophene-2-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 3-amino-4-(4-fluorophenyl)thiophene-2-carboxylate 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 Methyl 3-amino-4-(4-fluorophenyl)thiophene-2-carboxylate?
The CAS number of Methyl 3-amino-4-(4-fluorophenyl)thiophene-2-carboxylate is 156274-32-7.
What is the molecular formula of Methyl 3-amino-4-(4-fluorophenyl)thiophene-2-carboxylate?
The molecular formula of Methyl 3-amino-4-(4-fluorophenyl)thiophene-2-carboxylate is C12H10FNO2S.
What is the molecular weight of Methyl 3-amino-4-(4-fluorophenyl)thiophene-2-carboxylate?
The molecular weight of Methyl 3-amino-4-(4-fluorophenyl)thiophene-2-carboxylate is 251.04 g/mol.
Where can I buy Methyl 3-amino-4-(4-fluorophenyl)thiophene-2-carboxylate?
You can request a quote for Methyl 3-amino-4-(4-fluorophenyl)thiophene-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 3-amino-4-(4-fluorophenyl)thiophene-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-amino-4-(4-fluorophenyl)thiophene-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.