![1'-Allyl-5'-methylspiro[[1,3]dioxolane-2,3'-indolin]-2'-one structure](/static/products/331/331949-41-8.png)
1'-Allyl-5'-methylspiro[[1,3]dioxolane-2,3'-indolin]-2'-one
TL;DR: 1'-Allyl-5'-methylspiro[[1,3]dioxolane-2,3'-indolin]-2'-one (CAS 331949-41-8) is a chemical compound with molecular formula C14H15NO3 and molecular weight 245.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5'-methyl-1'-prop-2-enylspiro[1,3-dioxolane-2,3'-indole]-2'-one
Also Known As: ChemDiv1_017879, BAS 00665702, A0895/0042014, 1'-allyl-5'-methylspiro[[1,3]dioxolane-2,3'-indolin]-2'-one, 5'-methyl-1'-prop-2-enylspiro[1,3-dioxolane-2,3'-indole]-2'-one
| Molecular Formula | C14H15NO3 |
|---|---|
| Molecular Weight | 245.11 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 38.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 245.1052 |
| Heavy Atoms | 18 |
| Complexity | 362.0 |
Chemical Identifiers
| CAS Number | 331949-41-8 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)N(C(=O)C23OCCO3)CC=C |
| InChIKey | SXSOPDXHKXLOGA-UHFFFAOYSA-N |
Product Overview
1'-Allyl-5'-methylspiro[[1,3]dioxolane-2,3'-indolin]-2'-one (CAS 331949-41-8), with molecular formula C14H15NO3 and molecular weight 245.11 g/mol. IUPAC: 5'-methyl-1'-prop-2-enylspiro[1,3-dioxolane-2,3'-indole]-2'-one.
Chemical Property Profile of 1'-Allyl-5'-methylspiro[[1,3]dioxolane-2,3'-indolin]-2'-one
Property Insights of 1'-Allyl-5'-methylspiro[[1,3]dioxolane-2,3'-indolin]-2'-one
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1'-Allyl-5'-methylspiro[[1,3]dioxolane-2,3'-indolin]-2'-one. With a topological polar surface area (TPSA) of 38.8 Ų, 1'-Allyl-5'-methylspiro[[1,3]dioxolane-2,3'-indolin]-2'-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1'-Allyl-5'-methylspiro[[1,3]dioxolane-2,3'-indolin]-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'-Allyl-5'-methylspiro[[1,3]dioxolane-2,3'-indolin]-2'-one?
The CAS number of 1'-Allyl-5'-methylspiro[[1,3]dioxolane-2,3'-indolin]-2'-one is 331949-41-8.
What is the molecular formula of 1'-Allyl-5'-methylspiro[[1,3]dioxolane-2,3'-indolin]-2'-one?
The molecular formula of 1'-Allyl-5'-methylspiro[[1,3]dioxolane-2,3'-indolin]-2'-one is C14H15NO3.
What is the molecular weight of 1'-Allyl-5'-methylspiro[[1,3]dioxolane-2,3'-indolin]-2'-one?
The molecular weight of 1'-Allyl-5'-methylspiro[[1,3]dioxolane-2,3'-indolin]-2'-one is 245.11 g/mol.
Where can I buy 1'-Allyl-5'-methylspiro[[1,3]dioxolane-2,3'-indolin]-2'-one?
You can request a quote for 1'-Allyl-5'-methylspiro[[1,3]dioxolane-2,3'-indolin]-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'-Allyl-5'-methylspiro[[1,3]dioxolane-2,3'-indolin]-2'-one?
Yes, KEHONG BIO provides custom synthesis services for 1'-Allyl-5'-methylspiro[[1,3]dioxolane-2,3'-indolin]-2'-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.