![1-[4-(Benzenesulfonyl)-2-(2-fluorophenyl)-1,3-oxazol-5-YL]azepane structure](/static/products/6188/618862-97-8.webp)
1-[4-(Benzenesulfonyl)-2-(2-fluorophenyl)-1,3-oxazol-5-YL]azepane
TL;DR: 1-[4-(Benzenesulfonyl)-2-(2-fluorophenyl)-1,3-oxazol-5-YL]azepane (CAS 618862-97-8) is a chemical compound with molecular formula C21H21FN2O3S and molecular weight 400.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(azepan-1-yl)-4-(benzenesulfonyl)-2-(2-fluorophenyl)-1,3-oxazole
Also Known As: 1-[4-(BENZENESULFONYL)-2-(2-FLUOROPHENYL)-1,3-OXAZOL-5-YL]AZEPANE, F1460-0242, 1-[2-(2-fluorophenyl)-4-(phenylsulfonyl)-1,3-oxazol-5-yl]azepane, 5-(azepan-1-yl)-4-(benzenesulfonyl)-2-(2-fluorophenyl)-1,3-oxazole, A3445/0146271
| Molecular Formula | C21H21FN2O3S |
|---|---|
| Molecular Weight | 400.13 g/mol |
| LogP | 4.6939 |
| Topological Polar Surface Area | 63.41 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 400.1257 |
| Heavy Atoms | 28 |
| Complexity | 1056.2645 |
Chemical Identifiers
| CAS Number | 618862-97-8 |
|---|---|
| SMILES | C1CCCN(CC1)C2=C(N=C(O2)C3=CC=CC=C3F)S(=O)(=O)C4=CC=CC=C4 |
Product Overview
1-[4-(Benzenesulfonyl)-2-(2-fluorophenyl)-1,3-oxazol-5-YL]azepane (CAS 618862-97-8), with molecular formula C21H21FN2O3S and molecular weight 400.13 g/mol. IUPAC: 5-(azepan-1-yl)-4-(benzenesulfonyl)-2-(2-fluorophenyl)-1,3-oxazole.
Chemical Property Profile of 1-[4-(Benzenesulfonyl)-2-(2-fluorophenyl)-1,3-oxazol-5-YL]azepane
Property Insights of 1-[4-(Benzenesulfonyl)-2-(2-fluorophenyl)-1,3-oxazol-5-YL]azepane
The XLogP value of 4.6939 indicates that 1-[4-(Benzenesulfonyl)-2-(2-fluorophenyl)-1,3-oxazol-5-YL]azepane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.41 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[4-(Benzenesulfonyl)-2-(2-fluorophenyl)-1,3-oxazol-5-YL]azepane. Following Lipinski's Rule of Five, 1-[4-(Benzenesulfonyl)-2-(2-fluorophenyl)-1,3-oxazol-5-YL]azepane has 0 hydrogen bond donor(s) and 5 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 1-[4-(Benzenesulfonyl)-2-(2-fluorophenyl)-1,3-oxazol-5-YL]azepane?
The CAS number of 1-[4-(Benzenesulfonyl)-2-(2-fluorophenyl)-1,3-oxazol-5-YL]azepane is 618862-97-8.
What is the molecular formula of 1-[4-(Benzenesulfonyl)-2-(2-fluorophenyl)-1,3-oxazol-5-YL]azepane?
The molecular formula of 1-[4-(Benzenesulfonyl)-2-(2-fluorophenyl)-1,3-oxazol-5-YL]azepane is C21H21FN2O3S.
What is the molecular weight of 1-[4-(Benzenesulfonyl)-2-(2-fluorophenyl)-1,3-oxazol-5-YL]azepane?
The molecular weight of 1-[4-(Benzenesulfonyl)-2-(2-fluorophenyl)-1,3-oxazol-5-YL]azepane is 400.13 g/mol.
Where can I buy 1-[4-(Benzenesulfonyl)-2-(2-fluorophenyl)-1,3-oxazol-5-YL]azepane?
You can request a quote for 1-[4-(Benzenesulfonyl)-2-(2-fluorophenyl)-1,3-oxazol-5-YL]azepane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[4-(Benzenesulfonyl)-2-(2-fluorophenyl)-1,3-oxazol-5-YL]azepane?
Yes, KEHONG BIO provides custom synthesis services for 1-[4-(Benzenesulfonyl)-2-(2-fluorophenyl)-1,3-oxazol-5-YL]azepane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.