![1'-benzylspiro[1,3-dioxolane-2,3'-indol]-2'(1'H)-one structure](/static/products/113/113549-04-5.webp)
1'-benzylspiro[1,3-dioxolane-2,3'-indol]-2'(1'H)-one
TL;DR: 1'-benzylspiro[1,3-dioxolane-2,3'-indol]-2'(1'H)-one (CAS 113549-04-5) is a chemical compound with molecular formula C17H15NO3 and molecular weight 281.1052 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1'-benzylspiro[1,3-dioxolane-2,3'-indole]-2'-one
Also Known As: 1'-benzylspiro[1,3-dioxolane-2,3'-indol]-2'(1'H)-one, 6-benzylspiro[1,3-dioxolane-2,3'-indoline]-7-one, 1'-benzylspiro[1,3-dioxolane-2,3'-indole]-2'-one, 1'-benzylspiro[[1,3]dioxolane-2,3'-indolin]-2'-one
Technical Specifications
| Molecular Formula | C17H15NO3 |
| Molecular Weight | 281.1052 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 38.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 281.1052 Da |
| Heavy Atoms | 21 |
| Complexity | 399.0 |
| SMILES | C1COC2(O1)C3=CC=CC=C3N(C2=O)CC4=CC=CC=C4 |
| InChIKey | VHZGWEHDOSHOQU-UHFFFAOYSA-N |
Chemical Property Profile of 1'-benzylspiro[1,3-dioxolane-2,3'-indol]-2'(1'H)-one
Property Insights of 1'-benzylspiro[1,3-dioxolane-2,3'-indol]-2'(1'H)-one
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1'-benzylspiro[1,3-dioxolane-2,3'-indol]-2'(1'H)-one. With a topological polar surface area (TPSA) of 38.8 Ų, 1'-benzylspiro[1,3-dioxolane-2,3'-indol]-2'(1'H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1'-benzylspiro[1,3-dioxolane-2,3'-indol]-2'(1'H)-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
What is the CAS number of 1'-benzylspiro[1,3-dioxolane-2,3'-indol]-2'(1'H)-one?
The CAS number of 1'-benzylspiro[1,3-dioxolane-2,3'-indol]-2'(1'H)-one is 113549-04-5.
What is the molecular formula of 1'-benzylspiro[1,3-dioxolane-2,3'-indol]-2'(1'H)-one?
The molecular formula of 1'-benzylspiro[1,3-dioxolane-2,3'-indol]-2'(1'H)-one is C17H15NO3.
What is the molecular weight of 1'-benzylspiro[1,3-dioxolane-2,3'-indol]-2'(1'H)-one?
The molecular weight of 1'-benzylspiro[1,3-dioxolane-2,3'-indol]-2'(1'H)-one is 281.1052 g/mol.
Where can I buy 1'-benzylspiro[1,3-dioxolane-2,3'-indol]-2'(1'H)-one?
You can request a quote for 1'-benzylspiro[1,3-dioxolane-2,3'-indol]-2'(1'H)-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1'-benzylspiro[1,3-dioxolane-2,3'-indol]-2'(1'H)-one?
Yes, CoreyChem provides custom synthesis services for 1'-benzylspiro[1,3-dioxolane-2,3'-indol]-2'(1'H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.