1,3(2H,4H)-Isoquinolinedione, 2-(4-chlorophenyl)-
TL;DR: 1,3(2H,4H)-Isoquinolinedione, 2-(4-chlorophenyl)- (CAS 83907-64-6) is a chemical compound with molecular formula C15H10ClNO2 and molecular weight 271.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-chlorophenyl)-4H-isoquinoline-1,3-dione
Also Known As: 1,3(2H,4H)-Isoquinolinedione, 2-(4-chlorophenyl)-, 2-(4-chlorophenyl)isoquinoline-1,3(2H,4H)-dione, 2-(4-chlorophenyl)-4H-isoquinoline-1,3-dione, 2-(4-chlorophenyl)isoquinoline-1,3 (2h,4h)-dione, 2-(4-chlorophenyl)isoquinoline-1,3(2H,4H )-dione
| Molecular Formula | C15H10ClNO2 |
|---|---|
| Molecular Weight | 271.04 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 37.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 271.04 |
| Heavy Atoms | 19 |
| Complexity | 376.0 |
Chemical Identifiers
| CAS Number | 83907-64-6 |
|---|---|
| SMILES | C1C2=CC=CC=C2C(=O)N(C1=O)C3=CC=C(C=C3)Cl |
| InChIKey | VCAVXRXBRBLYDE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,3(2H,4H)-Isoquinolinedione, 2-(4-chlorophenyl)- (CAS 83907-64-6), with molecular formula C15H10ClNO2 and molecular weight 271.04 g/mol. IUPAC: 2-(4-chlorophenyl)-4H-isoquinoline-1,3-dione.
Chemical Property Profile of 1,3(2H,4H)-Isoquinolinedione, 2-(4-chlorophenyl)-
Property Insights of 1,3(2H,4H)-Isoquinolinedione, 2-(4-chlorophenyl)-
The XLogP value of 3.0 indicates that 1,3(2H,4H)-Isoquinolinedione, 2-(4-chlorophenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.4 Ų, 1,3(2H,4H)-Isoquinolinedione, 2-(4-chlorophenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3(2H,4H)-Isoquinolinedione, 2-(4-chlorophenyl)- has 0 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 1,3(2H,4H)-Isoquinolinedione, 2-(4-chlorophenyl)-?
The CAS number of 1,3(2H,4H)-Isoquinolinedione, 2-(4-chlorophenyl)- is 83907-64-6.
What is the molecular formula of 1,3(2H,4H)-Isoquinolinedione, 2-(4-chlorophenyl)-?
The molecular formula of 1,3(2H,4H)-Isoquinolinedione, 2-(4-chlorophenyl)- is C15H10ClNO2.
What is the molecular weight of 1,3(2H,4H)-Isoquinolinedione, 2-(4-chlorophenyl)-?
The molecular weight of 1,3(2H,4H)-Isoquinolinedione, 2-(4-chlorophenyl)- is 271.04 g/mol.
Where can I buy 1,3(2H,4H)-Isoquinolinedione, 2-(4-chlorophenyl)-?
You can request a quote for 1,3(2H,4H)-Isoquinolinedione, 2-(4-chlorophenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3(2H,4H)-Isoquinolinedione, 2-(4-chlorophenyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1,3(2H,4H)-Isoquinolinedione, 2-(4-chlorophenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.