Azetidine,1-acetyl-3-chloro
TL;DR: Azetidine,1-acetyl-3-chloro (CAS 179894-84-9) is a chemical compound with molecular formula C19H18N2 and molecular weight 274.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2,2,4-trimethyl-1H-quinolin-6-yl)benzonitrile
Also Known As: Azetidine,1-acetyl-3-chloro, 3-(2,2,4-trimethyl-1H-quinolin-6-yl)benzonitrile, Benzonitrile, 3-(1,2-dihydro-2,2,4-trimethyl-6-quinolinyl)-, J1.007.087B, 3-(1,2-Dihydro-2,2,4-trimethyl-6-quinolinyl)benzonitrile
| Molecular Formula | C19H18N2 |
|---|---|
| Molecular Weight | 274.15 g/mol |
| LogP | 4.83268 |
| Topological Polar Surface Area | 35.82 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 274.147 |
| Heavy Atoms | 21 |
| Complexity | 776.3936 |
Chemical Identifiers
| CAS Number | 179894-84-9 |
|---|---|
| SMILES | CC1=CC(NC2=C1C=C(C=C2)C3=CC=CC(=C3)C#N)(C)C |
Product Overview
Azetidine,1-acetyl-3-chloro (CAS 179894-84-9), with molecular formula C19H18N2 and molecular weight 274.15 g/mol. IUPAC: 3-(2,2,4-trimethyl-1H-quinolin-6-yl)benzonitrile.
Chemical Property Profile of Azetidine,1-acetyl-3-chloro
Property Insights of Azetidine,1-acetyl-3-chloro
The XLogP value of 4.83268 indicates that Azetidine,1-acetyl-3-chloro is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.82 Ų, Azetidine,1-acetyl-3-chloro exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Azetidine,1-acetyl-3-chloro 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 Azetidine,1-acetyl-3-chloro?
The CAS number of Azetidine,1-acetyl-3-chloro is 179894-84-9.
What is the molecular formula of Azetidine,1-acetyl-3-chloro?
The molecular formula of Azetidine,1-acetyl-3-chloro is C19H18N2.
What is the molecular weight of Azetidine,1-acetyl-3-chloro?
The molecular weight of Azetidine,1-acetyl-3-chloro is 274.15 g/mol.
Where can I buy Azetidine,1-acetyl-3-chloro?
You can request a quote for Azetidine,1-acetyl-3-chloro directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Azetidine,1-acetyl-3-chloro?
Yes, KEHONG BIO provides custom synthesis services for Azetidine,1-acetyl-3-chloro and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.