1(3H)-Isobenzofuranone, 3-(2-quinolinylmethylene)-
TL;DR: 1(3H)-Isobenzofuranone, 3-(2-quinolinylmethylene)- (CAS 6365-50-0) is a chemical compound with molecular formula C18H11NO2 and molecular weight 273.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(quinolin-2-ylmethylidene)-2-benzofuran-1-one
Also Known As: 3-(2-Quinolylmethylene)phthalide, 1(3H)-Isobenzofuranone, 3-(2-quinolinylmethylene)-, Phthalide, 3-(2-quinolylmethylene)-, 3-(quinolin-2-ylmethylidene)-2-benzofuran-1-one, EINECS 228-857-8
| Molecular Formula | C18H11NO2 |
|---|---|
| Molecular Weight | 273.08 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 39.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 273.07898 |
| Heavy Atoms | 21 |
| Complexity | 444.0 |
Chemical Identifiers
| CAS Number | 6365-50-0 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC(=N2)C=C3C4=CC=CC=C4C(=O)O3 |
| InChIKey | CXPDELLOVTUCGG-UHFFFAOYSA-N |
Product Overview
1(3H)-Isobenzofuranone, 3-(2-quinolinylmethylene)- (CAS 6365-50-0), with molecular formula C18H11NO2 and molecular weight 273.08 g/mol. IUPAC: 3-(quinolin-2-ylmethylidene)-2-benzofuran-1-one.
Chemical Property Profile of 1(3H)-Isobenzofuranone, 3-(2-quinolinylmethylene)-
Property Insights of 1(3H)-Isobenzofuranone, 3-(2-quinolinylmethylene)-
The XLogP value of 3.8 indicates that 1(3H)-Isobenzofuranone, 3-(2-quinolinylmethylene)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.2 Ų, 1(3H)-Isobenzofuranone, 3-(2-quinolinylmethylene)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1(3H)-Isobenzofuranone, 3-(2-quinolinylmethylene)- has 0 hydrogen bond donor(s) and 3 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(3H)-Isobenzofuranone, 3-(2-quinolinylmethylene)-?
The CAS number of 1(3H)-Isobenzofuranone, 3-(2-quinolinylmethylene)- is 6365-50-0.
What is the molecular formula of 1(3H)-Isobenzofuranone, 3-(2-quinolinylmethylene)-?
The molecular formula of 1(3H)-Isobenzofuranone, 3-(2-quinolinylmethylene)- is C18H11NO2.
What is the molecular weight of 1(3H)-Isobenzofuranone, 3-(2-quinolinylmethylene)-?
The molecular weight of 1(3H)-Isobenzofuranone, 3-(2-quinolinylmethylene)- is 273.08 g/mol.
Where can I buy 1(3H)-Isobenzofuranone, 3-(2-quinolinylmethylene)-?
You can request a quote for 1(3H)-Isobenzofuranone, 3-(2-quinolinylmethylene)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1(3H)-Isobenzofuranone, 3-(2-quinolinylmethylene)-?
Yes, KEHONG BIO provides custom synthesis services for 1(3H)-Isobenzofuranone, 3-(2-quinolinylmethylene)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.