4H-Isoquinoline-1,3-dione, 2-(3-chlorophenyl)-
TL;DR: 4H-Isoquinoline-1,3-dione, 2-(3-chlorophenyl)- (CAS 25451-73-4) 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-(3-chlorophenyl)-4H-isoquinoline-1,3-dione
Also Known As: Dimethylisophthalate, 2-(3-chloro-phenyl)-4h-isoquinoline-1,3-dione, 2-(3-Chlorophenyl)-4H-isoquinoline-1,3-dione, Dimethoxybis(pentafluorophenyl)silane, 4H-Isoquinoline-1,3-dione, 2-(3-chlorophenyl)-
| 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 | 384.0 |
Chemical Identifiers
| CAS Number | 25451-73-4 |
|---|---|
| SMILES | C1C2=CC=CC=C2C(=O)N(C1=O)C3=CC(=CC=C3)Cl |
| InChIKey | YILPTMFWSYOSGN-UHFFFAOYSA-N |
Product Overview
4H-Isoquinoline-1,3-dione, 2-(3-chlorophenyl)- (CAS 25451-73-4), with molecular formula C15H10ClNO2 and molecular weight 271.04 g/mol. IUPAC: 2-(3-chlorophenyl)-4H-isoquinoline-1,3-dione.
Chemical Property Profile of 4H-Isoquinoline-1,3-dione, 2-(3-chlorophenyl)-
Property Insights of 4H-Isoquinoline-1,3-dione, 2-(3-chlorophenyl)-
The XLogP value of 3.0 indicates that 4H-Isoquinoline-1,3-dione, 2-(3-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, 4H-Isoquinoline-1,3-dione, 2-(3-chlorophenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4H-Isoquinoline-1,3-dione, 2-(3-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 4H-Isoquinoline-1,3-dione, 2-(3-chlorophenyl)-?
The CAS number of 4H-Isoquinoline-1,3-dione, 2-(3-chlorophenyl)- is 25451-73-4.
What is the molecular formula of 4H-Isoquinoline-1,3-dione, 2-(3-chlorophenyl)-?
The molecular formula of 4H-Isoquinoline-1,3-dione, 2-(3-chlorophenyl)- is C15H10ClNO2.
What is the molecular weight of 4H-Isoquinoline-1,3-dione, 2-(3-chlorophenyl)-?
The molecular weight of 4H-Isoquinoline-1,3-dione, 2-(3-chlorophenyl)- is 271.04 g/mol.
Where can I buy 4H-Isoquinoline-1,3-dione, 2-(3-chlorophenyl)-?
You can request a quote for 4H-Isoquinoline-1,3-dione, 2-(3-chlorophenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4H-Isoquinoline-1,3-dione, 2-(3-chlorophenyl)-?
Yes, KEHONG BIO provides custom synthesis services for 4H-Isoquinoline-1,3-dione, 2-(3-chlorophenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.