Propan-2-YL 6-bromo-2-methyl-5-methylsulfonyloxy-benzofuran-3-carboxylate
TL;DR: Propan-2-YL 6-bromo-2-methyl-5-methylsulfonyloxy-benzofuran-3-carboxylate (CAS 308295-33-2) is a chemical compound with molecular formula C14H15BrO6S and molecular weight 389.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl 6-bromo-2-methyl-5-methylsulfonyloxy-1-benzofuran-3-carboxylate
Also Known As: BAS 02375874, BIM-0003147.P001, AE-641/15338346, propan-2-yl 6-bromo-5-(methanesulfonyloxy)-2-methyl-1-benzofuran-3-carboxylate, F0821-0307
| Molecular Formula | C14H15BrO6S |
|---|---|
| Molecular Weight | 389.98 g/mol |
| LogP | 3.40732 |
| Topological Polar Surface Area | 82.81 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 389.97726 |
| Heavy Atoms | 22 |
| Complexity | 834.62537 |
Chemical Identifiers
| CAS Number | 308295-33-2 |
|---|---|
| SMILES | CC1=C(C2=CC(=C(C=C2O1)Br)OS(=O)(=O)C)C(=O)OC(C)C |
Product Overview
Propan-2-YL 6-bromo-2-methyl-5-methylsulfonyloxy-benzofuran-3-carboxylate (CAS 308295-33-2), with molecular formula C14H15BrO6S and molecular weight 389.98 g/mol. IUPAC: propan-2-yl 6-bromo-2-methyl-5-methylsulfonyloxy-1-benzofuran-3-carboxylate.
Chemical Property Profile of Propan-2-YL 6-bromo-2-methyl-5-methylsulfonyloxy-benzofuran-3-carboxylate
Property Insights of Propan-2-YL 6-bromo-2-methyl-5-methylsulfonyloxy-benzofuran-3-carboxylate
The XLogP value of 3.40732 indicates that Propan-2-YL 6-bromo-2-methyl-5-methylsulfonyloxy-benzofuran-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.81 Ų falls within the moderate polarity range, balancing permeability and solubility for Propan-2-YL 6-bromo-2-methyl-5-methylsulfonyloxy-benzofuran-3-carboxylate. Following Lipinski's Rule of Five, Propan-2-YL 6-bromo-2-methyl-5-methylsulfonyloxy-benzofuran-3-carboxylate has 0 hydrogen bond donor(s) and 6 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 Propan-2-YL 6-bromo-2-methyl-5-methylsulfonyloxy-benzofuran-3-carboxylate?
The CAS number of Propan-2-YL 6-bromo-2-methyl-5-methylsulfonyloxy-benzofuran-3-carboxylate is 308295-33-2.
What is the molecular formula of Propan-2-YL 6-bromo-2-methyl-5-methylsulfonyloxy-benzofuran-3-carboxylate?
The molecular formula of Propan-2-YL 6-bromo-2-methyl-5-methylsulfonyloxy-benzofuran-3-carboxylate is C14H15BrO6S.
What is the molecular weight of Propan-2-YL 6-bromo-2-methyl-5-methylsulfonyloxy-benzofuran-3-carboxylate?
The molecular weight of Propan-2-YL 6-bromo-2-methyl-5-methylsulfonyloxy-benzofuran-3-carboxylate is 389.98 g/mol.
Where can I buy Propan-2-YL 6-bromo-2-methyl-5-methylsulfonyloxy-benzofuran-3-carboxylate?
You can request a quote for Propan-2-YL 6-bromo-2-methyl-5-methylsulfonyloxy-benzofuran-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propan-2-YL 6-bromo-2-methyl-5-methylsulfonyloxy-benzofuran-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Propan-2-YL 6-bromo-2-methyl-5-methylsulfonyloxy-benzofuran-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.