4-methyl-2-oxo-3-phenyl-2H-chromen-7-yl thiophene-2-carboxylate
TL;DR: 4-methyl-2-oxo-3-phenyl-2H-chromen-7-yl thiophene-2-carboxylate (CAS 869080-31-9) is a chemical compound with molecular formula C21H14O4S and molecular weight 362.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-methyl-2-oxo-3-phenylchromen-7-yl) thiophene-2-carboxylate
Also Known As: 4-methyl-2-oxo-3-phenyl-2H-chromen-7-yl thiophene-2-carboxylate, (4-methyl-2-oxo-3-phenylchromen-7-yl) thiophene-2-carboxylate, F1862-0297, 4-methyl-2-oxo-3-phenylchromen-7-yl thiophene-2-carboxylate
| Molecular Formula | C21H14O4S |
|---|---|
| Molecular Weight | 362.06 g/mol |
| LogP | 5.04912 |
| Topological Polar Surface Area | 56.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 362.06128 |
| Heavy Atoms | 26 |
| Complexity | 1142.0736 |
Chemical Identifiers
| CAS Number | 869080-31-9 |
|---|---|
| SMILES | CC1=C(C(=O)OC2=C1C=CC(=C2)OC(=O)C3=CC=CS3)C4=CC=CC=C4 |
Product Overview
4-methyl-2-oxo-3-phenyl-2H-chromen-7-yl thiophene-2-carboxylate (CAS 869080-31-9), with molecular formula C21H14O4S and molecular weight 362.06 g/mol. IUPAC: (4-methyl-2-oxo-3-phenylchromen-7-yl) thiophene-2-carboxylate.
Chemical Property Profile of 4-methyl-2-oxo-3-phenyl-2H-chromen-7-yl thiophene-2-carboxylate
Property Insights of 4-methyl-2-oxo-3-phenyl-2H-chromen-7-yl thiophene-2-carboxylate
The XLogP value of 5.04912 indicates that 4-methyl-2-oxo-3-phenyl-2H-chromen-7-yl thiophene-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.51 Ų, 4-methyl-2-oxo-3-phenyl-2H-chromen-7-yl thiophene-2-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-methyl-2-oxo-3-phenyl-2H-chromen-7-yl thiophene-2-carboxylate has 0 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 4-methyl-2-oxo-3-phenyl-2H-chromen-7-yl thiophene-2-carboxylate?
The CAS number of 4-methyl-2-oxo-3-phenyl-2H-chromen-7-yl thiophene-2-carboxylate is 869080-31-9.
What is the molecular formula of 4-methyl-2-oxo-3-phenyl-2H-chromen-7-yl thiophene-2-carboxylate?
The molecular formula of 4-methyl-2-oxo-3-phenyl-2H-chromen-7-yl thiophene-2-carboxylate is C21H14O4S.
What is the molecular weight of 4-methyl-2-oxo-3-phenyl-2H-chromen-7-yl thiophene-2-carboxylate?
The molecular weight of 4-methyl-2-oxo-3-phenyl-2H-chromen-7-yl thiophene-2-carboxylate is 362.06 g/mol.
Where can I buy 4-methyl-2-oxo-3-phenyl-2H-chromen-7-yl thiophene-2-carboxylate?
You can request a quote for 4-methyl-2-oxo-3-phenyl-2H-chromen-7-yl 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 4-methyl-2-oxo-3-phenyl-2H-chromen-7-yl thiophene-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for 4-methyl-2-oxo-3-phenyl-2H-chromen-7-yl thiophene-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.