IFLab1_004278
TL;DR: IFLab1_004278 (CAS 423137-40-0) is a chemical compound with molecular formula C21H22ClFN2O3 and molecular weight 404.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2-chloro-6-fluorophenyl)-2-methyl-3-(morpholine-4-carbonyl)-4,6,7,8-tetrahydro-1H-quinolin-5-one
Also Known As: IFLab1_004278, BAS 09588528, IDI1_010033, F0917-4524, 4-(2-chloro-6-fluorophenyl)-2-methyl-3-(4-morpholinylcarbonyl)-4,6,7,8-tetrahydro-5(1H)-quinolinone
| Molecular Formula | C21H22ClFN2O3 |
|---|---|
| Molecular Weight | 404.13 g/mol |
| LogP | 3.3058 |
| Topological Polar Surface Area | 58.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 404.1303 |
| Heavy Atoms | 28 |
| Complexity | 882.6618 |
Chemical Identifiers
| CAS Number | 423137-40-0 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)CCCC2=O)C3=C(C=CC=C3Cl)F)C(=O)N4CCOCC4 |
Product Overview
IFLab1_004278 (CAS 423137-40-0), with molecular formula C21H22ClFN2O3 and molecular weight 404.13 g/mol. IUPAC: 4-(2-chloro-6-fluorophenyl)-2-methyl-3-(morpholine-4-carbonyl)-4,6,7,8-tetrahydro-1H-quinolin-5-one.
Chemical Property Profile of IFLab1_004278
Property Insights of IFLab1_004278
The XLogP value of 3.3058 indicates that IFLab1_004278 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.64 Ų, IFLab1_004278 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, IFLab1_004278 has 1 hydrogen bond donor(s) and 4 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 IFLab1_004278?
The CAS number of IFLab1_004278 is 423137-40-0.
What is the molecular formula of IFLab1_004278?
The molecular formula of IFLab1_004278 is C21H22ClFN2O3.
What is the molecular weight of IFLab1_004278?
The molecular weight of IFLab1_004278 is 404.13 g/mol.
Where can I buy IFLab1_004278?
You can request a quote for IFLab1_004278 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for IFLab1_004278?
Yes, KEHONG BIO provides custom synthesis services for IFLab1_004278 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.