AB00090292-01
TL;DR: AB00090292-01 (CAS 1005068-86-9) 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-(3-bromophenyl)spiro[4-azatricyclo[5.2.1.02,6]dec-8-ene-10,1'-cyclopropane]-3,5-dione
Also Known As: AB00090292-01, 2-(3-bromophenyl)-3a,4,7,7a-tetrahydro-1H-spiro[2-aza-4,7-methanoisoindole-8,1'-cyclopropane]-1,3(2H)-dione, (3aR,4R,7S,7aS)-2-(3-bromophenyl)-3a,4,7,7a-tetrahydro-1H-spiro[4,7-methanoisoindole-8,1'-cyclopropane]-1,3(2H)-dione, 2-(3-bromophenyl)-3a,4,7,7a-tetrahydro-1H-spiro[4,7-methanoisoindole-8,1'-cyclopropane]-1,3(2H)-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 | 1005068-86-9 |
|---|---|
| SMILES | C1CC12C3C=CC2C4C3C(=O)N(C4=O)C5=CC(=CC=C5)Br |
Product Overview
AB00090292-01 (CAS 1005068-86-9), with molecular formula C17H14BrNO2 and molecular weight 343.02 g/mol. IUPAC: 4-(3-bromophenyl)spiro[4-azatricyclo[5.2.1.02,6]dec-8-ene-10,1'-cyclopropane]-3,5-dione.
Chemical Property Profile of AB00090292-01
Property Insights of AB00090292-01
The XLogP value of 3.1507 indicates that AB00090292-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.38 Ų, AB00090292-01 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AB00090292-01 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 AB00090292-01?
The CAS number of AB00090292-01 is 1005068-86-9.
What is the molecular formula of AB00090292-01?
The molecular formula of AB00090292-01 is C17H14BrNO2.
What is the molecular weight of AB00090292-01?
The molecular weight of AB00090292-01 is 343.02 g/mol.
Where can I buy AB00090292-01?
You can request a quote for AB00090292-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00090292-01?
Yes, KEHONG BIO provides custom synthesis services for AB00090292-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.