![1'-Benzyl-5'-methylspiro[1,3-dioxane-2,3'-indole]-2'-one structure](/static/products/853/853751-58-3.png)
1'-Benzyl-5'-methylspiro[1,3-dioxane-2,3'-indole]-2'-one
TL;DR: 1'-Benzyl-5'-methylspiro[1,3-dioxane-2,3'-indole]-2'-one (CAS 853751-58-3) is a chemical compound with molecular formula C19H19NO3 and molecular weight 309.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1'-benzyl-5'-methylspiro[1,3-dioxane-2,3'-indole]-2'-one
Also Known As: BAS 12945987, 1'-benzyl-5'-methylspiro[1,3-dioxane-2,3'-indole]-2'-one, AT-057/43275452, F3026-0054, 1-benzyl-5-methylspiro[indoline-3,2'-[1,3]dioxan]-2-one
| Molecular Formula | C19H19NO3 |
|---|---|
| Molecular Weight | 309.14 g/mol |
| LogP | 3.13152 |
| Topological Polar Surface Area | 38.77 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 309.1365 |
| Heavy Atoms | 23 |
| Complexity | 735.53485 |
Chemical Identifiers
| CAS Number | 853751-58-3 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)N(C(=O)C23OCCCO3)CC4=CC=CC=C4 |
Product Overview
1'-Benzyl-5'-methylspiro[1,3-dioxane-2,3'-indole]-2'-one (CAS 853751-58-3), with molecular formula C19H19NO3 and molecular weight 309.14 g/mol. IUPAC: 1'-benzyl-5'-methylspiro[1,3-dioxane-2,3'-indole]-2'-one.
Chemical Property Profile of 1'-Benzyl-5'-methylspiro[1,3-dioxane-2,3'-indole]-2'-one
Property Insights of 1'-Benzyl-5'-methylspiro[1,3-dioxane-2,3'-indole]-2'-one
The XLogP value of 3.13152 indicates that 1'-Benzyl-5'-methylspiro[1,3-dioxane-2,3'-indole]-2'-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.77 Ų, 1'-Benzyl-5'-methylspiro[1,3-dioxane-2,3'-indole]-2'-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1'-Benzyl-5'-methylspiro[1,3-dioxane-2,3'-indole]-2'-one 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'-Benzyl-5'-methylspiro[1,3-dioxane-2,3'-indole]-2'-one?
The CAS number of 1'-Benzyl-5'-methylspiro[1,3-dioxane-2,3'-indole]-2'-one is 853751-58-3.
What is the molecular formula of 1'-Benzyl-5'-methylspiro[1,3-dioxane-2,3'-indole]-2'-one?
The molecular formula of 1'-Benzyl-5'-methylspiro[1,3-dioxane-2,3'-indole]-2'-one is C19H19NO3.
What is the molecular weight of 1'-Benzyl-5'-methylspiro[1,3-dioxane-2,3'-indole]-2'-one?
The molecular weight of 1'-Benzyl-5'-methylspiro[1,3-dioxane-2,3'-indole]-2'-one is 309.14 g/mol.
Where can I buy 1'-Benzyl-5'-methylspiro[1,3-dioxane-2,3'-indole]-2'-one?
You can request a quote for 1'-Benzyl-5'-methylspiro[1,3-dioxane-2,3'-indole]-2'-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1'-Benzyl-5'-methylspiro[1,3-dioxane-2,3'-indole]-2'-one?
Yes, KEHONG BIO provides custom synthesis services for 1'-Benzyl-5'-methylspiro[1,3-dioxane-2,3'-indole]-2'-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.