6-(3'-Methylbuten-2'-yl)isatin
TL;DR: 6-(3'-Methylbuten-2'-yl)isatin (CAS 101023-73-8) is a chemical compound with molecular formula C13H13NO2 and molecular weight 215.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(3-methylbut-2-enyl)-1H-indole-2,3-dione
Also Known As: 6-Mbyi, 6-Isopentenylisatin, 6-Isopentenylisatine, 6-(3'-Methylbuten-2'-yl)isatin, 6-(3-methylbut-2-enyl)isatin
| Molecular Formula | C13H13NO2 |
|---|---|
| Molecular Weight | 215.09 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 46.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 215.09464 |
| Heavy Atoms | 16 |
| Complexity | 342.0 |
Chemical Identifiers
| CAS Number | 101023-73-8 |
|---|---|
| SMILES | CC(=CCC1=CC2=C(C=C1)C(=O)C(=O)N2)C |
| InChIKey | MWJAKDCTOHITQV-UHFFFAOYSA-N |
Product Overview
6-(3'-Methylbuten-2'-yl)isatin (CAS 101023-73-8), with molecular formula C13H13NO2 and molecular weight 215.09 g/mol. IUPAC: 6-(3-methylbut-2-enyl)-1H-indole-2,3-dione.
Chemical Property Profile of 6-(3'-Methylbuten-2'-yl)isatin
Property Insights of 6-(3'-Methylbuten-2'-yl)isatin
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-(3'-Methylbuten-2'-yl)isatin. With a topological polar surface area (TPSA) of 46.2 Ų, 6-(3'-Methylbuten-2'-yl)isatin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-(3'-Methylbuten-2'-yl)isatin has 1 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 6-(3'-Methylbuten-2'-yl)isatin?
The CAS number of 6-(3'-Methylbuten-2'-yl)isatin is 101023-73-8.
What is the molecular formula of 6-(3'-Methylbuten-2'-yl)isatin?
The molecular formula of 6-(3'-Methylbuten-2'-yl)isatin is C13H13NO2.
What is the molecular weight of 6-(3'-Methylbuten-2'-yl)isatin?
The molecular weight of 6-(3'-Methylbuten-2'-yl)isatin is 215.09 g/mol.
Where can I buy 6-(3'-Methylbuten-2'-yl)isatin?
You can request a quote for 6-(3'-Methylbuten-2'-yl)isatin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(3'-Methylbuten-2'-yl)isatin?
Yes, KEHONG BIO provides custom synthesis services for 6-(3'-Methylbuten-2'-yl)isatin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.