5-(1,3-Benzothiazol-2-yl)-2-(4-methoxyphenyl)isoindole-1,3-dione
TL;DR: 5-(1,3-Benzothiazol-2-yl)-2-(4-methoxyphenyl)isoindole-1,3-dione (CAS 690970-36-6) is a chemical compound with molecular formula C22H14N2O3S and molecular weight 386.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(1,3-benzothiazol-2-yl)-2-(4-methoxyphenyl)isoindole-1,3-dione
Also Known As: 5-(1,3-benzothiazol-2-yl)-2-(4-methoxyphenyl)isoindole-1,3-dione, 5-(1,3-benzothiazol-2-yl)-2-(4-methoxyphenyl)-1H-isoindole-1,3(2H)-dione
| Molecular Formula | C22H14N2O3S |
|---|---|
| Molecular Weight | 386.07 g/mol |
| LogP | 4.7725 |
| Topological Polar Surface Area | 59.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 386.0725 |
| Heavy Atoms | 28 |
| Complexity | 1211.3743 |
Chemical Identifiers
| CAS Number | 690970-36-6 |
|---|---|
| SMILES | COC1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C4=NC5=CC=CC=C5S4 |
Product Overview
5-(1,3-Benzothiazol-2-yl)-2-(4-methoxyphenyl)isoindole-1,3-dione (CAS 690970-36-6), with molecular formula C22H14N2O3S and molecular weight 386.07 g/mol. IUPAC: 5-(1,3-benzothiazol-2-yl)-2-(4-methoxyphenyl)isoindole-1,3-dione.
Chemical Property Profile of 5-(1,3-Benzothiazol-2-yl)-2-(4-methoxyphenyl)isoindole-1,3-dione
Property Insights of 5-(1,3-Benzothiazol-2-yl)-2-(4-methoxyphenyl)isoindole-1,3-dione
The XLogP value of 4.7725 indicates that 5-(1,3-Benzothiazol-2-yl)-2-(4-methoxyphenyl)isoindole-1,3-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.5 Ų, 5-(1,3-Benzothiazol-2-yl)-2-(4-methoxyphenyl)isoindole-1,3-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(1,3-Benzothiazol-2-yl)-2-(4-methoxyphenyl)isoindole-1,3-dione has 0 hydrogen bond donor(s) and 5 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 5-(1,3-Benzothiazol-2-yl)-2-(4-methoxyphenyl)isoindole-1,3-dione?
The CAS number of 5-(1,3-Benzothiazol-2-yl)-2-(4-methoxyphenyl)isoindole-1,3-dione is 690970-36-6.
What is the molecular formula of 5-(1,3-Benzothiazol-2-yl)-2-(4-methoxyphenyl)isoindole-1,3-dione?
The molecular formula of 5-(1,3-Benzothiazol-2-yl)-2-(4-methoxyphenyl)isoindole-1,3-dione is C22H14N2O3S.
What is the molecular weight of 5-(1,3-Benzothiazol-2-yl)-2-(4-methoxyphenyl)isoindole-1,3-dione?
The molecular weight of 5-(1,3-Benzothiazol-2-yl)-2-(4-methoxyphenyl)isoindole-1,3-dione is 386.07 g/mol.
Where can I buy 5-(1,3-Benzothiazol-2-yl)-2-(4-methoxyphenyl)isoindole-1,3-dione?
You can request a quote for 5-(1,3-Benzothiazol-2-yl)-2-(4-methoxyphenyl)isoindole-1,3-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(1,3-Benzothiazol-2-yl)-2-(4-methoxyphenyl)isoindole-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 5-(1,3-Benzothiazol-2-yl)-2-(4-methoxyphenyl)isoindole-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.