![N-[(2H-1,3-Benzodioxol-5-yl)methyl]-4-(4-fluorobenzene-1-sulfonyl)-2-(thiophen-2-yl)-1,3-oxazol-5-amine structure](/static/products/7065/7065-42-1.webp)
N-[(2H-1,3-Benzodioxol-5-yl)methyl]-4-(4-fluorobenzene-1-sulfonyl)-2-(thiophen-2-yl)-1,3-oxazol-5-amine
TL;DR: N-[(2H-1,3-Benzodioxol-5-yl)methyl]-4-(4-fluorobenzene-1-sulfonyl)-2-(thiophen-2-yl)-1,3-oxazol-5-amine (CAS 7065-42-1) is a chemical compound with molecular formula C21H15FN2O5S2 and molecular weight 458.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzodioxol-5-ylmethyl)-4-(4-fluorophenyl)sulfonyl-2-thiophen-2-yl-1,3-oxazol-5-amine
Also Known As: N-[(2H-1,3-Benzodioxol-5-yl)methyl]-4-(4-fluorobenzene-1-sulfonyl)-2-(thiophen-2-yl)-1,3-oxazol-5-amine, N-(1,3-benzodioxol-5-ylmethyl)-4-(4-fluorophenyl)sulfonyl-2-thiophen-2-yl-1,3-oxazol-5-amine, N-(benzo[1,3]dioxol-5-ylmethyl)-4-(4-fluorophenyl)sulfonyl-2-thiophen-2-yl-1,3-oxazol-5-amine
| Molecular Formula | C21H15FN2O5S2 |
|---|---|
| Molecular Weight | 458.04 g/mol |
| LogP | 4.7158 |
| Topological Polar Surface Area | 90.66 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 458.04065 |
| Heavy Atoms | 31 |
| Complexity | 1332.8645 |
Chemical Identifiers
| CAS Number | 7065-42-1 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)CNC3=C(N=C(O3)C4=CC=CS4)S(=O)(=O)C5=CC=C(C=C5)F |
Product Overview
N-[(2H-1,3-Benzodioxol-5-yl)methyl]-4-(4-fluorobenzene-1-sulfonyl)-2-(thiophen-2-yl)-1,3-oxazol-5-amine (CAS 7065-42-1), with molecular formula C21H15FN2O5S2 and molecular weight 458.04 g/mol. IUPAC: N-(1,3-benzodioxol-5-ylmethyl)-4-(4-fluorophenyl)sulfonyl-2-thiophen-2-yl-1,3-oxazol-5-amine.
Chemical Property Profile of N-[(2H-1,3-Benzodioxol-5-yl)methyl]-4-(4-fluorobenzene-1-sulfonyl)-2-(thiophen-2-yl)-1,3-oxazol-5-amine
Property Insights of N-[(2H-1,3-Benzodioxol-5-yl)methyl]-4-(4-fluorobenzene-1-sulfonyl)-2-(thiophen-2-yl)-1,3-oxazol-5-amine
The XLogP value of 4.7158 indicates that N-[(2H-1,3-Benzodioxol-5-yl)methyl]-4-(4-fluorobenzene-1-sulfonyl)-2-(thiophen-2-yl)-1,3-oxazol-5-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.66 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(2H-1,3-Benzodioxol-5-yl)methyl]-4-(4-fluorobenzene-1-sulfonyl)-2-(thiophen-2-yl)-1,3-oxazol-5-amine. Following Lipinski's Rule of Five, N-[(2H-1,3-Benzodioxol-5-yl)methyl]-4-(4-fluorobenzene-1-sulfonyl)-2-(thiophen-2-yl)-1,3-oxazol-5-amine has 1 hydrogen bond donor(s) and 8 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 N-[(2H-1,3-Benzodioxol-5-yl)methyl]-4-(4-fluorobenzene-1-sulfonyl)-2-(thiophen-2-yl)-1,3-oxazol-5-amine?
The CAS number of N-[(2H-1,3-Benzodioxol-5-yl)methyl]-4-(4-fluorobenzene-1-sulfonyl)-2-(thiophen-2-yl)-1,3-oxazol-5-amine is 7065-42-1.
What is the molecular formula of N-[(2H-1,3-Benzodioxol-5-yl)methyl]-4-(4-fluorobenzene-1-sulfonyl)-2-(thiophen-2-yl)-1,3-oxazol-5-amine?
The molecular formula of N-[(2H-1,3-Benzodioxol-5-yl)methyl]-4-(4-fluorobenzene-1-sulfonyl)-2-(thiophen-2-yl)-1,3-oxazol-5-amine is C21H15FN2O5S2.
What is the molecular weight of N-[(2H-1,3-Benzodioxol-5-yl)methyl]-4-(4-fluorobenzene-1-sulfonyl)-2-(thiophen-2-yl)-1,3-oxazol-5-amine?
The molecular weight of N-[(2H-1,3-Benzodioxol-5-yl)methyl]-4-(4-fluorobenzene-1-sulfonyl)-2-(thiophen-2-yl)-1,3-oxazol-5-amine is 458.04 g/mol.
Where can I buy N-[(2H-1,3-Benzodioxol-5-yl)methyl]-4-(4-fluorobenzene-1-sulfonyl)-2-(thiophen-2-yl)-1,3-oxazol-5-amine?
You can request a quote for N-[(2H-1,3-Benzodioxol-5-yl)methyl]-4-(4-fluorobenzene-1-sulfonyl)-2-(thiophen-2-yl)-1,3-oxazol-5-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(2H-1,3-Benzodioxol-5-yl)methyl]-4-(4-fluorobenzene-1-sulfonyl)-2-(thiophen-2-yl)-1,3-oxazol-5-amine?
Yes, KEHONG BIO provides custom synthesis services for N-[(2H-1,3-Benzodioxol-5-yl)methyl]-4-(4-fluorobenzene-1-sulfonyl)-2-(thiophen-2-yl)-1,3-oxazol-5-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.