1(2H)-Isoquinolinone, 3-(4-chlorophenyl)-
TL;DR: 1(2H)-Isoquinolinone, 3-(4-chlorophenyl)- (CAS 124394-22-5) is a chemical compound with molecular formula C15H10ClNO and molecular weight 255.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-chlorophenyl)-2H-isoquinolin-1-one
Also Known As: 1(2H)-Isoquinolinone, 3-(4-chlorophenyl)-, 3-(4-Chlorophenyl)isoquinolin-1(2H)-one, 3-(4-chlorophenyl)-2H-isoquinolin-1-one, 3-(p-chlorophenyl)isoquinolin-1(2H)-one, 3-(4-Chlorophenyl)isoquinoline-1(2H)-one
| Molecular Formula | C15H10ClNO |
|---|---|
| Molecular Weight | 255.05 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 255.04509 |
| Heavy Atoms | 18 |
| Complexity | 358.0 |
Chemical Identifiers
| CAS Number | 124394-22-5 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=C(NC2=O)C3=CC=C(C=C3)Cl |
| InChIKey | KJGKATNJRZANRI-UHFFFAOYSA-N |
Product Overview
1(2H)-Isoquinolinone, 3-(4-chlorophenyl)- (CAS 124394-22-5), with molecular formula C15H10ClNO and molecular weight 255.05 g/mol. IUPAC: 3-(4-chlorophenyl)-2H-isoquinolin-1-one.
Chemical Property Profile of 1(2H)-Isoquinolinone, 3-(4-chlorophenyl)-
Property Insights of 1(2H)-Isoquinolinone, 3-(4-chlorophenyl)-
The XLogP value of 3.6 indicates that 1(2H)-Isoquinolinone, 3-(4-chlorophenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, 1(2H)-Isoquinolinone, 3-(4-chlorophenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1(2H)-Isoquinolinone, 3-(4-chlorophenyl)- has 1 hydrogen bond donor(s) and 1 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(2H)-Isoquinolinone, 3-(4-chlorophenyl)-?
The CAS number of 1(2H)-Isoquinolinone, 3-(4-chlorophenyl)- is 124394-22-5.
What is the molecular formula of 1(2H)-Isoquinolinone, 3-(4-chlorophenyl)-?
The molecular formula of 1(2H)-Isoquinolinone, 3-(4-chlorophenyl)- is C15H10ClNO.
What is the molecular weight of 1(2H)-Isoquinolinone, 3-(4-chlorophenyl)-?
The molecular weight of 1(2H)-Isoquinolinone, 3-(4-chlorophenyl)- is 255.05 g/mol.
Where can I buy 1(2H)-Isoquinolinone, 3-(4-chlorophenyl)-?
You can request a quote for 1(2H)-Isoquinolinone, 3-(4-chlorophenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1(2H)-Isoquinolinone, 3-(4-chlorophenyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1(2H)-Isoquinolinone, 3-(4-chlorophenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.