A1306/0059389
TL;DR: A1306/0059389 (CAS 331626-99-4) is a chemical compound with molecular formula C17H14BrNO2 and molecular weight 343.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2-bromophenyl)spiro[4-azatricyclo[5.2.1.02,6]dec-8-ene-10,1'-cyclopropane]-3,5-dione
Also Known As: A1306/0059389, 2-(2-bromophenyl)-3a,4,7,7a-tetrahydro-1H-spiro[2-aza-4,7-methanoisoindole-8,1'-cyclopropane]-1,3(2H)-dione, 4-(2-bromophenyl)spiro[4-azatricyclo[5.2.1.02,6]dec-8-ene-10,1'-cyclopropane]-3,5-dione, 2-(2-bromophenyl)-3a,4,7,7a-tetrahydro-1H-spiro[4,7-methanoisoindole-8,1'-cyclopropane]-1,3(2H)-dione, 4-(2-bromophenyl)-spiro[4-azatricyclo[5.2.1.0~2,6~]dec[8]ene-10,1'-cyclopropane]-3,5-dione
| Molecular Formula | C17H14BrNO2 |
|---|---|
| Molecular Weight | 343.02 g/mol |
| LogP | 3.1507 |
| Topological Polar Surface Area | 37.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 343.02078 |
| Heavy Atoms | 21 |
| Complexity | 687.25525 |
Chemical Identifiers
| CAS Number | 331626-99-4 |
|---|---|
| SMILES | C1CC12C3C=CC2C4C3C(=O)N(C4=O)C5=CC=CC=C5Br |
Product Overview
A1306/0059389 (CAS 331626-99-4), with molecular formula C17H14BrNO2 and molecular weight 343.02 g/mol. IUPAC: 4-(2-bromophenyl)spiro[4-azatricyclo[5.2.1.02,6]dec-8-ene-10,1'-cyclopropane]-3,5-dione.
Chemical Property Profile of A1306/0059389
Property Insights of A1306/0059389
The XLogP value of 3.1507 indicates that A1306/0059389 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.38 Ų, A1306/0059389 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, A1306/0059389 has 0 hydrogen bond donor(s) and 2 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 A1306/0059389?
The CAS number of A1306/0059389 is 331626-99-4.
What is the molecular formula of A1306/0059389?
The molecular formula of A1306/0059389 is C17H14BrNO2.
What is the molecular weight of A1306/0059389?
The molecular weight of A1306/0059389 is 343.02 g/mol.
Where can I buy A1306/0059389?
You can request a quote for A1306/0059389 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A1306/0059389?
Yes, KEHONG BIO provides custom synthesis services for A1306/0059389 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.