5-tert-butyl-2,3-dihydro-1H-indole-2,3-dione
TL;DR: 5-tert-butyl-2,3-dihydro-1H-indole-2,3-dione (CAS 2475-68-5) is a chemical compound with molecular formula C12H13NO2 and molecular weight 203.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-tert-butyl-1H-indole-2,3-dione
Also Known As: 5-t-butylisatin, 5-(tert-Butyl)indoline-2,3-dione, 5-tert-butyl-2,3-dihydro-1H-indole-2,3-dione, 5-tert-Butyl-1H-indole-2,3-dione, 5-tert-Butylindoline-2,3-dione
| Molecular Formula | C12H13NO2 |
|---|---|
| Molecular Weight | 203.09 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 46.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 203.09464 |
| Heavy Atoms | 15 |
| Complexity | 303.0 |
Chemical Identifiers
| CAS Number | 2475-68-5 |
|---|---|
| SMILES | CC(C)(C)C1=CC2=C(C=C1)NC(=O)C2=O |
| InChIKey | FQRSABMKACVJDD-UHFFFAOYSA-N |
Product Overview
5-tert-butyl-2,3-dihydro-1H-indole-2,3-dione (CAS 2475-68-5), with molecular formula C12H13NO2 and molecular weight 203.09 g/mol. IUPAC: 5-tert-butyl-1H-indole-2,3-dione.
Chemical Property Profile of 5-tert-butyl-2,3-dihydro-1H-indole-2,3-dione
Property Insights of 5-tert-butyl-2,3-dihydro-1H-indole-2,3-dione
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-tert-butyl-2,3-dihydro-1H-indole-2,3-dione. With a topological polar surface area (TPSA) of 46.2 Ų, 5-tert-butyl-2,3-dihydro-1H-indole-2,3-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-tert-butyl-2,3-dihydro-1H-indole-2,3-dione 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 5-tert-butyl-2,3-dihydro-1H-indole-2,3-dione?
The CAS number of 5-tert-butyl-2,3-dihydro-1H-indole-2,3-dione is 2475-68-5.
What is the molecular formula of 5-tert-butyl-2,3-dihydro-1H-indole-2,3-dione?
The molecular formula of 5-tert-butyl-2,3-dihydro-1H-indole-2,3-dione is C12H13NO2.
What is the molecular weight of 5-tert-butyl-2,3-dihydro-1H-indole-2,3-dione?
The molecular weight of 5-tert-butyl-2,3-dihydro-1H-indole-2,3-dione is 203.09 g/mol.
Where can I buy 5-tert-butyl-2,3-dihydro-1H-indole-2,3-dione?
You can request a quote for 5-tert-butyl-2,3-dihydro-1H-indole-2,3-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-tert-butyl-2,3-dihydro-1H-indole-2,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 5-tert-butyl-2,3-dihydro-1H-indole-2,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.