1-(1,3-Dioxaindan-5-yl)-4-(4-chlorophenyl)-3,3-difluoroazetidin-2-one
TL;DR: 1-(1,3-Dioxaindan-5-yl)-4-(4-chlorophenyl)-3,3-difluoroazetidin-2-one (CAS 326025-71-2) is a chemical compound with molecular formula C16H10ClF2NO3 and molecular weight 337.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1,3-benzodioxol-5-yl)-4-(4-chlorophenyl)-3,3-difluoroazetidin-2-one
Also Known As: AF-399/13478012, 1-(1,3-dioxaindan-5-yl)-4-(4-chlorophenyl)-3,3-difluoroazetidin-2-one, 1-(1,3-benzodioxol-5-yl)-4-(4-chlorophenyl)-3,3-difluoro-2-azetidinone, 1-(1,3-benzodioxol-5-yl)-4-(4-chlorophenyl)-3,3-difluoroazetidin-2-one
| Molecular Formula | C16H10ClF2NO3 |
|---|---|
| Molecular Weight | 337.03 g/mol |
| LogP | 3.7919 |
| Topological Polar Surface Area | 38.77 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 337.03174 |
| Heavy Atoms | 23 |
| Complexity | 794.4124 |
Chemical Identifiers
| CAS Number | 326025-71-2 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)N3C(C(C3=O)(F)F)C4=CC=C(C=C4)Cl |
Product Overview
1-(1,3-Dioxaindan-5-yl)-4-(4-chlorophenyl)-3,3-difluoroazetidin-2-one (CAS 326025-71-2), with molecular formula C16H10ClF2NO3 and molecular weight 337.03 g/mol. IUPAC: 1-(1,3-benzodioxol-5-yl)-4-(4-chlorophenyl)-3,3-difluoroazetidin-2-one.
Chemical Property Profile of 1-(1,3-Dioxaindan-5-yl)-4-(4-chlorophenyl)-3,3-difluoroazetidin-2-one
Property Insights of 1-(1,3-Dioxaindan-5-yl)-4-(4-chlorophenyl)-3,3-difluoroazetidin-2-one
The XLogP value of 3.7919 indicates that 1-(1,3-Dioxaindan-5-yl)-4-(4-chlorophenyl)-3,3-difluoroazetidin-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.77 Ų, 1-(1,3-Dioxaindan-5-yl)-4-(4-chlorophenyl)-3,3-difluoroazetidin-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(1,3-Dioxaindan-5-yl)-4-(4-chlorophenyl)-3,3-difluoroazetidin-2-one has 0 hydrogen bond donor(s) and 3 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-(1,3-Dioxaindan-5-yl)-4-(4-chlorophenyl)-3,3-difluoroazetidin-2-one?
The CAS number of 1-(1,3-Dioxaindan-5-yl)-4-(4-chlorophenyl)-3,3-difluoroazetidin-2-one is 326025-71-2.
What is the molecular formula of 1-(1,3-Dioxaindan-5-yl)-4-(4-chlorophenyl)-3,3-difluoroazetidin-2-one?
The molecular formula of 1-(1,3-Dioxaindan-5-yl)-4-(4-chlorophenyl)-3,3-difluoroazetidin-2-one is C16H10ClF2NO3.
What is the molecular weight of 1-(1,3-Dioxaindan-5-yl)-4-(4-chlorophenyl)-3,3-difluoroazetidin-2-one?
The molecular weight of 1-(1,3-Dioxaindan-5-yl)-4-(4-chlorophenyl)-3,3-difluoroazetidin-2-one is 337.03 g/mol.
Where can I buy 1-(1,3-Dioxaindan-5-yl)-4-(4-chlorophenyl)-3,3-difluoroazetidin-2-one?
You can request a quote for 1-(1,3-Dioxaindan-5-yl)-4-(4-chlorophenyl)-3,3-difluoroazetidin-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(1,3-Dioxaindan-5-yl)-4-(4-chlorophenyl)-3,3-difluoroazetidin-2-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(1,3-Dioxaindan-5-yl)-4-(4-chlorophenyl)-3,3-difluoroazetidin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.