(5-(Thiophen-2-yl)isoxazol-3-yl)methyl 3-(phenylsulfonyl)propanoate
TL;DR: (5-(Thiophen-2-yl)isoxazol-3-yl)methyl 3-(phenylsulfonyl)propanoate (CAS 1206998-48-2) is a chemical compound with molecular formula C17H15NO5S2 and molecular weight 377.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 3-(benzenesulfonyl)propanoate
Also Known As: (5-(thiophen-2-yl)isoxazol-3-yl)methyl 3-(phenylsulfonyl)propanoate, (5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 3-(benzenesulfonyl)propanoate, [5-(thiophen-2-yl)-1,2-oxazol-3-yl]methyl 3-(benzenesulfonyl)propanoate, F2496-2889
| Molecular Formula | C17H15NO5S2 |
|---|---|
| Molecular Weight | 377.04 g/mol |
| LogP | 3.3103 |
| Topological Polar Surface Area | 86.47 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 377.03915 |
| Heavy Atoms | 25 |
| Complexity | 930.60065 |
Chemical Identifiers
| CAS Number | 1206998-48-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)S(=O)(=O)CCC(=O)OCC2=NOC(=C2)C3=CC=CS3 |
Product Overview
(5-(Thiophen-2-yl)isoxazol-3-yl)methyl 3-(phenylsulfonyl)propanoate (CAS 1206998-48-2), with molecular formula C17H15NO5S2 and molecular weight 377.04 g/mol. IUPAC: (5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 3-(benzenesulfonyl)propanoate.
Chemical Property Profile of (5-(Thiophen-2-yl)isoxazol-3-yl)methyl 3-(phenylsulfonyl)propanoate
Property Insights of (5-(Thiophen-2-yl)isoxazol-3-yl)methyl 3-(phenylsulfonyl)propanoate
The XLogP value of 3.3103 indicates that (5-(Thiophen-2-yl)isoxazol-3-yl)methyl 3-(phenylsulfonyl)propanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.47 Ų falls within the moderate polarity range, balancing permeability and solubility for (5-(Thiophen-2-yl)isoxazol-3-yl)methyl 3-(phenylsulfonyl)propanoate. Following Lipinski's Rule of Five, (5-(Thiophen-2-yl)isoxazol-3-yl)methyl 3-(phenylsulfonyl)propanoate has 0 hydrogen bond donor(s) and 7 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 (5-(Thiophen-2-yl)isoxazol-3-yl)methyl 3-(phenylsulfonyl)propanoate?
The CAS number of (5-(Thiophen-2-yl)isoxazol-3-yl)methyl 3-(phenylsulfonyl)propanoate is 1206998-48-2.
What is the molecular formula of (5-(Thiophen-2-yl)isoxazol-3-yl)methyl 3-(phenylsulfonyl)propanoate?
The molecular formula of (5-(Thiophen-2-yl)isoxazol-3-yl)methyl 3-(phenylsulfonyl)propanoate is C17H15NO5S2.
What is the molecular weight of (5-(Thiophen-2-yl)isoxazol-3-yl)methyl 3-(phenylsulfonyl)propanoate?
The molecular weight of (5-(Thiophen-2-yl)isoxazol-3-yl)methyl 3-(phenylsulfonyl)propanoate is 377.04 g/mol.
Where can I buy (5-(Thiophen-2-yl)isoxazol-3-yl)methyl 3-(phenylsulfonyl)propanoate?
You can request a quote for (5-(Thiophen-2-yl)isoxazol-3-yl)methyl 3-(phenylsulfonyl)propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (5-(Thiophen-2-yl)isoxazol-3-yl)methyl 3-(phenylsulfonyl)propanoate?
Yes, KEHONG BIO provides custom synthesis services for (5-(Thiophen-2-yl)isoxazol-3-yl)methyl 3-(phenylsulfonyl)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.