2,4-Azetidinedione, 3-ethyl-3-phenyl-
TL;DR: 2,4-Azetidinedione, 3-ethyl-3-phenyl- (CAS 42282-82-6) is a chemical compound with molecular formula C11H11NO2 and molecular weight 189.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-ethyl-3-phenylazetidine-2,4-dione
Also Known As: Malonimide, 2-ethyl-2-phenyl-, 2,4-Azetidinedione, 3-ethyl-3-phenyl-, 3-ethyl-3-phenylazetidine-2,4-dione, 3-Ethyl-3-phenylazetidin-2,4-dione, 3-ethyl-3-phenyl-azetidine-2,4-dione
| Molecular Formula | C11H11NO2 |
|---|---|
| Molecular Weight | 189.08 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 46.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 189.07898 |
| Heavy Atoms | 14 |
| Complexity | 252.0 |
Chemical Identifiers
| CAS Number | 42282-82-6 |
|---|---|
| SMILES | CCC1(C(=O)NC1=O)C2=CC=CC=C2 |
| InChIKey | DBNSSSWQTICKIC-UHFFFAOYSA-N |
Product Overview
2,4-Azetidinedione, 3-ethyl-3-phenyl- (CAS 42282-82-6), with molecular formula C11H11NO2 and molecular weight 189.08 g/mol. IUPAC: 3-ethyl-3-phenylazetidine-2,4-dione.
Chemical Property Profile of 2,4-Azetidinedione, 3-ethyl-3-phenyl-
Property Insights of 2,4-Azetidinedione, 3-ethyl-3-phenyl-
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4-Azetidinedione, 3-ethyl-3-phenyl-. With a topological polar surface area (TPSA) of 46.2 Ų, 2,4-Azetidinedione, 3-ethyl-3-phenyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4-Azetidinedione, 3-ethyl-3-phenyl- has 1 hydrogen bond donor(s) and 2 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 2,4-Azetidinedione, 3-ethyl-3-phenyl-?
The CAS number of 2,4-Azetidinedione, 3-ethyl-3-phenyl- is 42282-82-6.
What is the molecular formula of 2,4-Azetidinedione, 3-ethyl-3-phenyl-?
The molecular formula of 2,4-Azetidinedione, 3-ethyl-3-phenyl- is C11H11NO2.
What is the molecular weight of 2,4-Azetidinedione, 3-ethyl-3-phenyl-?
The molecular weight of 2,4-Azetidinedione, 3-ethyl-3-phenyl- is 189.08 g/mol.
Where can I buy 2,4-Azetidinedione, 3-ethyl-3-phenyl-?
You can request a quote for 2,4-Azetidinedione, 3-ethyl-3-phenyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-Azetidinedione, 3-ethyl-3-phenyl-?
Yes, KEHONG BIO provides custom synthesis services for 2,4-Azetidinedione, 3-ethyl-3-phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.