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Methyl 2-amino-4-[1,1'-biphenyl]-4-yl-3-thiophenecarboxylate
TL;DR: Methyl 2-amino-4-[1,1'-biphenyl]-4-yl-3-thiophenecarboxylate (CAS 350997-16-9) is a chemical compound with molecular formula C18H15NO2S and molecular weight 309.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-amino-4-(4-phenylphenyl)thiophene-3-carboxylate
Also Known As: methyl 2-amino-4-(1,1'-biphenyl-4-yl)thiophene-3-carboxylate, methyl 2-amino-4-(4-phenylphenyl)thiophene-3-carboxylate, methyl 2-amino-4-{[1,1'-biphenyl]-4-yl}thiophene-3-carboxylate, methyl 2-amino-4-(biphenyl-4-yl)thiophene-3-carboxylate, 2-Amino-4-biphenyl-4-yl-thiophene-3-carboxylic acid methyl ester
| Molecular Formula | C18H15NO2S |
|---|---|
| Molecular Weight | 309.08 g/mol |
| LogP | 4.4509 |
| Topological Polar Surface Area | 52.32 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 309.08234 |
| Heavy Atoms | 22 |
| Complexity | 791.7143 |
Chemical Identifiers
| CAS Number | 350997-16-9 |
|---|---|
| SMILES | COC(=O)C1=C(SC=C1C2=CC=C(C=C2)C3=CC=CC=C3)N |
Product Overview
Methyl 2-amino-4-[1,1'-biphenyl]-4-yl-3-thiophenecarboxylate (CAS 350997-16-9), with molecular formula C18H15NO2S and molecular weight 309.08 g/mol. IUPAC: methyl 2-amino-4-(4-phenylphenyl)thiophene-3-carboxylate.
Chemical Property Profile of Methyl 2-amino-4-[1,1'-biphenyl]-4-yl-3-thiophenecarboxylate
Property Insights of Methyl 2-amino-4-[1,1'-biphenyl]-4-yl-3-thiophenecarboxylate
The XLogP value of 4.4509 indicates that Methyl 2-amino-4-[1,1'-biphenyl]-4-yl-3-thiophenecarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.32 Ų, Methyl 2-amino-4-[1,1'-biphenyl]-4-yl-3-thiophenecarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 2-amino-4-[1,1'-biphenyl]-4-yl-3-thiophenecarboxylate 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 2-amino-4-[1,1'-biphenyl]-4-yl-3-thiophenecarboxylate?
The CAS number of Methyl 2-amino-4-[1,1'-biphenyl]-4-yl-3-thiophenecarboxylate is 350997-16-9.
What is the molecular formula of Methyl 2-amino-4-[1,1'-biphenyl]-4-yl-3-thiophenecarboxylate?
The molecular formula of Methyl 2-amino-4-[1,1'-biphenyl]-4-yl-3-thiophenecarboxylate is C18H15NO2S.
What is the molecular weight of Methyl 2-amino-4-[1,1'-biphenyl]-4-yl-3-thiophenecarboxylate?
The molecular weight of Methyl 2-amino-4-[1,1'-biphenyl]-4-yl-3-thiophenecarboxylate is 309.08 g/mol.
Where can I buy Methyl 2-amino-4-[1,1'-biphenyl]-4-yl-3-thiophenecarboxylate?
You can request a quote for Methyl 2-amino-4-[1,1'-biphenyl]-4-yl-3-thiophenecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-amino-4-[1,1'-biphenyl]-4-yl-3-thiophenecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-amino-4-[1,1'-biphenyl]-4-yl-3-thiophenecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.