2-(Benzenesulfinyl)-1H-isoindole-1,3(2H)-dione
TL;DR: 2-(Benzenesulfinyl)-1H-isoindole-1,3(2H)-dione (CAS 40167-15-5) is a chemical compound with molecular formula C14H9NO3S and molecular weight 271.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(benzenesulfinyl)isoindole-1,3-dione
Also Known As: N- PHTHALIMIDE98, N-(PHENYLSULFINYL)PHTHALIMIDE, 2-(benzenesulfinyl)isoindole-1,3-dione, 2-(phenylsulfinyl)isoindoline-1,3-dione, 2-(Benzenesulfinyl)-1H-isoindole-1,3(2H)-dione
| Molecular Formula | C14H9NO3S |
|---|---|
| Molecular Weight | 271.03 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 73.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 271.0303 |
| Heavy Atoms | 19 |
| Complexity | 393.0 |
Chemical Identifiers
| CAS Number | 40167-15-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)S(=O)N2C(=O)C3=CC=CC=C3C2=O |
| InChIKey | JRBVENZNVISJCU-UHFFFAOYSA-N |
Product Overview
2-(Benzenesulfinyl)-1H-isoindole-1,3(2H)-dione (CAS 40167-15-5), with molecular formula C14H9NO3S and molecular weight 271.03 g/mol. IUPAC: 2-(benzenesulfinyl)isoindole-1,3-dione.
Chemical Property Profile of 2-(Benzenesulfinyl)-1H-isoindole-1,3(2H)-dione
Property Insights of 2-(Benzenesulfinyl)-1H-isoindole-1,3(2H)-dione
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Benzenesulfinyl)-1H-isoindole-1,3(2H)-dione. The TPSA of 73.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(Benzenesulfinyl)-1H-isoindole-1,3(2H)-dione. Following Lipinski's Rule of Five, 2-(Benzenesulfinyl)-1H-isoindole-1,3(2H)-dione has 0 hydrogen bond donor(s) and 4 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 2-(Benzenesulfinyl)-1H-isoindole-1,3(2H)-dione?
The CAS number of 2-(Benzenesulfinyl)-1H-isoindole-1,3(2H)-dione is 40167-15-5.
What is the molecular formula of 2-(Benzenesulfinyl)-1H-isoindole-1,3(2H)-dione?
The molecular formula of 2-(Benzenesulfinyl)-1H-isoindole-1,3(2H)-dione is C14H9NO3S.
What is the molecular weight of 2-(Benzenesulfinyl)-1H-isoindole-1,3(2H)-dione?
The molecular weight of 2-(Benzenesulfinyl)-1H-isoindole-1,3(2H)-dione is 271.03 g/mol.
Where can I buy 2-(Benzenesulfinyl)-1H-isoindole-1,3(2H)-dione?
You can request a quote for 2-(Benzenesulfinyl)-1H-isoindole-1,3(2H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Benzenesulfinyl)-1H-isoindole-1,3(2H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-(Benzenesulfinyl)-1H-isoindole-1,3(2H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.