5'-bromo-7'-methylspiro[1,3-dioxolane-2,3'-indol]-2'(1'H)-one
TL;DR: 5'-bromo-7'-methylspiro[1,3-dioxolane-2,3'-indol]-2'(1'H)-one (CAS 330978-23-9) is a chemical compound with molecular formula C11H10BrNO3 and molecular weight 282.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5'-bromo-7'-methylspiro[1,3-dioxolane-2,3'-1H-indole]-2'-one
Also Known As: BAS 00314619, BIM-0026307.P001, 5'-bromo-7'-methylspiro[1,3-dioxolane-2,3'-indol]-2'(1'H)-one, 5'-bromo-7'-methylspiro[1,3-dioxolane-2,3'-1H-indole]-2'-one, 5'-bromo-7'-methyl-1',3'-dihydrospiro[1,3-dioxolane-2,3'-(2'H)-indole]-2'-one
| Molecular Formula | C11H10BrNO3 |
|---|---|
| Molecular Weight | 282.98 g/mol |
| LogP | 1.90922 |
| Topological Polar Surface Area | 47.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 282.9844 |
| Heavy Atoms | 16 |
| Complexity | 480.36316 |
Chemical Identifiers
| CAS Number | 330978-23-9 |
|---|---|
| SMILES | CC1=CC(=CC2=C1NC(=O)C23OCCO3)Br |
Product Overview
5'-bromo-7'-methylspiro[1,3-dioxolane-2,3'-indol]-2'(1'H)-one (CAS 330978-23-9), with molecular formula C11H10BrNO3 and molecular weight 282.98 g/mol. IUPAC: 5'-bromo-7'-methylspiro[1,3-dioxolane-2,3'-1H-indole]-2'-one.
Chemical Property Profile of 5'-bromo-7'-methylspiro[1,3-dioxolane-2,3'-indol]-2'(1'H)-one
Property Insights of 5'-bromo-7'-methylspiro[1,3-dioxolane-2,3'-indol]-2'(1'H)-one
The XLogP value of 1.90922 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5'-bromo-7'-methylspiro[1,3-dioxolane-2,3'-indol]-2'(1'H)-one. With a topological polar surface area (TPSA) of 47.56 Ų, 5'-bromo-7'-methylspiro[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, 5'-bromo-7'-methylspiro[1,3-dioxolane-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'-bromo-7'-methylspiro[1,3-dioxolane-2,3'-indol]-2'(1'H)-one?
The CAS number of 5'-bromo-7'-methylspiro[1,3-dioxolane-2,3'-indol]-2'(1'H)-one is 330978-23-9.
What is the molecular formula of 5'-bromo-7'-methylspiro[1,3-dioxolane-2,3'-indol]-2'(1'H)-one?
The molecular formula of 5'-bromo-7'-methylspiro[1,3-dioxolane-2,3'-indol]-2'(1'H)-one is C11H10BrNO3.
What is the molecular weight of 5'-bromo-7'-methylspiro[1,3-dioxolane-2,3'-indol]-2'(1'H)-one?
The molecular weight of 5'-bromo-7'-methylspiro[1,3-dioxolane-2,3'-indol]-2'(1'H)-one is 282.98 g/mol.
Where can I buy 5'-bromo-7'-methylspiro[1,3-dioxolane-2,3'-indol]-2'(1'H)-one?
You can request a quote for 5'-bromo-7'-methylspiro[1,3-dioxolane-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'-bromo-7'-methylspiro[1,3-dioxolane-2,3'-indol]-2'(1'H)-one?
Yes, KEHONG BIO provides custom synthesis services for 5'-bromo-7'-methylspiro[1,3-dioxolane-2,3'-indol]-2'(1'H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.