5',7'-dimethylspiro[1,3-dioxane-2,3'-indol]-2'(1'H)-one
TL;DR: 5',7'-dimethylspiro[1,3-dioxane-2,3'-indol]-2'(1'H)-one (CAS 883633-85-0) is a chemical compound with molecular formula C13H15NO3 and molecular weight 233.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5',7'-dimethylspiro[1,3-dioxane-2,3'-1H-indole]-2'-one
Also Known As: 5',7'-dimethylspiro[1,3-dioxane-2,3'-indol]-2'(1'H)-one, 5',7'-dimethylspiro[1,3-dioxane-2,3'-1H-indole]-2'-one, 5',7'-dimethyl-1',2'-dihydrospiro([1,3]dioxane-2,3'-indole)-2'-one, AT-057/43468694, 5,7-dimethylspiro[indoline-3,2'-[1,3]dioxan]-2-one
| Molecular Formula | C13H15NO3 |
|---|---|
| Molecular Weight | 233.11 g/mol |
| LogP | 1.84524 |
| Topological Polar Surface Area | 47.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 233.1052 |
| Heavy Atoms | 17 |
| Complexity | 489.6831 |
Chemical Identifiers
| CAS Number | 883633-85-0 |
|---|---|
| SMILES | CC1=CC(=C2C(=C1)C3(C(=O)N2)OCCCO3)C |
Product Overview
5',7'-dimethylspiro[1,3-dioxane-2,3'-indol]-2'(1'H)-one (CAS 883633-85-0), with molecular formula C13H15NO3 and molecular weight 233.11 g/mol. IUPAC: 5',7'-dimethylspiro[1,3-dioxane-2,3'-1H-indole]-2'-one.
Chemical Property Profile of 5',7'-dimethylspiro[1,3-dioxane-2,3'-indol]-2'(1'H)-one
Property Insights of 5',7'-dimethylspiro[1,3-dioxane-2,3'-indol]-2'(1'H)-one
The XLogP value of 1.84524 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5',7'-dimethylspiro[1,3-dioxane-2,3'-indol]-2'(1'H)-one. With a topological polar surface area (TPSA) of 47.56 Ų, 5',7'-dimethylspiro[1,3-dioxane-2,3'-indol]-2'(1'H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5',7'-dimethylspiro[1,3-dioxane-2,3'-indol]-2'(1'H)-one has 1 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 5',7'-dimethylspiro[1,3-dioxane-2,3'-indol]-2'(1'H)-one?
The CAS number of 5',7'-dimethylspiro[1,3-dioxane-2,3'-indol]-2'(1'H)-one is 883633-85-0.
What is the molecular formula of 5',7'-dimethylspiro[1,3-dioxane-2,3'-indol]-2'(1'H)-one?
The molecular formula of 5',7'-dimethylspiro[1,3-dioxane-2,3'-indol]-2'(1'H)-one is C13H15NO3.
What is the molecular weight of 5',7'-dimethylspiro[1,3-dioxane-2,3'-indol]-2'(1'H)-one?
The molecular weight of 5',7'-dimethylspiro[1,3-dioxane-2,3'-indol]-2'(1'H)-one is 233.11 g/mol.
Where can I buy 5',7'-dimethylspiro[1,3-dioxane-2,3'-indol]-2'(1'H)-one?
You can request a quote for 5',7'-dimethylspiro[1,3-dioxane-2,3'-indol]-2'(1'H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5',7'-dimethylspiro[1,3-dioxane-2,3'-indol]-2'(1'H)-one?
Yes, KEHONG BIO provides custom synthesis services for 5',7'-dimethylspiro[1,3-dioxane-2,3'-indol]-2'(1'H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.