AB-131/42302813
TL;DR: AB-131/42302813 (CAS 783249-37-6) is a chemical compound with molecular formula C11H12BrNO2 and molecular weight 269.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1'-bromospiro[1,3-dioxolane-2,9'-pentacyclo[4.3.0.02,4.03,8.05,7]nonane]-4'-amine
Also Known As: AB-131/42302813, 1'-bromospiro(1,3-dioxolane-2,9'-pentacyclo[3.3.1.0~2,4~.0~3,7~.0~6,8~]nonane)-3'-ylamine, 1'-Bromospiro[1,3-dioxolane-2,9'-pentacyclo[4.3.0.02,4.03,8.05,7]nonane]-4'-amine, 1'-Bromohexahydrospiro[1,3-dioxolane-2,3'-[1,2]methanodicyclopropa[cd,gh]pentalen]-2'c(1'H)-amine
| Molecular Formula | C11H12BrNO2 |
|---|---|
| Molecular Weight | 269.01 g/mol |
| LogP | 0.3259 |
| Topological Polar Surface Area | 44.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 269.00513 |
| Heavy Atoms | 15 |
| Complexity | 436.30386 |
Chemical Identifiers
| CAS Number | 783249-37-6 |
|---|---|
| SMILES | C1COC2(O1)C3C4C5C4C2(C6C3C56N)Br |
Product Overview
AB-131/42302813 (CAS 783249-37-6), with molecular formula C11H12BrNO2 and molecular weight 269.01 g/mol. IUPAC: 1'-bromospiro[1,3-dioxolane-2,9'-pentacyclo[4.3.0.02,4.03,8.05,7]nonane]-4'-amine.
Chemical Property Profile of AB-131/42302813
Property Insights of AB-131/42302813
The XLogP value of 0.3259 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB-131/42302813. With a topological polar surface area (TPSA) of 44.48 Ų, AB-131/42302813 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AB-131/42302813 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 AB-131/42302813?
The CAS number of AB-131/42302813 is 783249-37-6.
What is the molecular formula of AB-131/42302813?
The molecular formula of AB-131/42302813 is C11H12BrNO2.
What is the molecular weight of AB-131/42302813?
The molecular weight of AB-131/42302813 is 269.01 g/mol.
Where can I buy AB-131/42302813?
You can request a quote for AB-131/42302813 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB-131/42302813?
Yes, KEHONG BIO provides custom synthesis services for AB-131/42302813 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.