![1-Methyl-3'-methylidenespiro[indole-3,5'-oxolane]-2,2'-dione structure](/static/products/7754/77547-08-1.webp)
1-Methyl-3'-methylidenespiro[indole-3,5'-oxolane]-2,2'-dione
TL;DR: 1-Methyl-3'-methylidenespiro[indole-3,5'-oxolane]-2,2'-dione (CAS 77547-08-1) is a chemical compound with molecular formula C13H11NO3 and molecular weight 229.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-3'-methylidenespiro[indole-3,5'-oxolane]-2,2'-dione
Also Known As: J3.184.533E, 1-methyl-3'-methylidenespiro[indole-3,5'-oxolane]-2,2'-dione, 1-Methyl-4'-methylidenespiro[indole-3,2'-oxolane]-2,5'(1H)-dione, 1-methyl-4'-methylidene-1,2-dihydrospiro[indole-3,2'-oxolane]-2,5'-dione, 1-Methyl-4 -methylenespiro[1H-indole-3(2H),2 (3 H)-furan]-2,5 (4 H)-dione
| Molecular Formula | C13H11NO3 |
|---|---|
| Molecular Weight | 229.07 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 46.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 229.0739 |
| Heavy Atoms | 17 |
| Complexity | 417.0 |
Chemical Identifiers
| CAS Number | 77547-08-1 |
|---|---|
| SMILES | CN1C2=CC=CC=C2C3(C1=O)CC(=C)C(=O)O3 |
| InChIKey | XSOLZJMKFMUBMH-UHFFFAOYSA-N |
Product Overview
1-Methyl-3'-methylidenespiro[indole-3,5'-oxolane]-2,2'-dione (CAS 77547-08-1), with molecular formula C13H11NO3 and molecular weight 229.07 g/mol. IUPAC: 1-methyl-3'-methylidenespiro[indole-3,5'-oxolane]-2,2'-dione.
Chemical Property Profile of 1-Methyl-3'-methylidenespiro[indole-3,5'-oxolane]-2,2'-dione
Property Insights of 1-Methyl-3'-methylidenespiro[indole-3,5'-oxolane]-2,2'-dione
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Methyl-3'-methylidenespiro[indole-3,5'-oxolane]-2,2'-dione. With a topological polar surface area (TPSA) of 46.6 Ų, 1-Methyl-3'-methylidenespiro[indole-3,5'-oxolane]-2,2'-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Methyl-3'-methylidenespiro[indole-3,5'-oxolane]-2,2'-dione 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-Methyl-3'-methylidenespiro[indole-3,5'-oxolane]-2,2'-dione?
The CAS number of 1-Methyl-3'-methylidenespiro[indole-3,5'-oxolane]-2,2'-dione is 77547-08-1.
What is the molecular formula of 1-Methyl-3'-methylidenespiro[indole-3,5'-oxolane]-2,2'-dione?
The molecular formula of 1-Methyl-3'-methylidenespiro[indole-3,5'-oxolane]-2,2'-dione is C13H11NO3.
What is the molecular weight of 1-Methyl-3'-methylidenespiro[indole-3,5'-oxolane]-2,2'-dione?
The molecular weight of 1-Methyl-3'-methylidenespiro[indole-3,5'-oxolane]-2,2'-dione is 229.07 g/mol.
Where can I buy 1-Methyl-3'-methylidenespiro[indole-3,5'-oxolane]-2,2'-dione?
You can request a quote for 1-Methyl-3'-methylidenespiro[indole-3,5'-oxolane]-2,2'-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methyl-3'-methylidenespiro[indole-3,5'-oxolane]-2,2'-dione?
Yes, KEHONG BIO provides custom synthesis services for 1-Methyl-3'-methylidenespiro[indole-3,5'-oxolane]-2,2'-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.