AB00098236-01
TL;DR: AB00098236-01 (CAS 5814-58-4) is a chemical compound with molecular formula C19H16N2O2 and molecular weight 304.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-methylquinolin-8-yl)-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione
Also Known As: AB00098236-01, 2-(4-methylquinolin-8-yl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione, 4-(4-methyl-8-quinolinyl)-4-azatricyclo[5.2.1.0~2,6~]dec-8-ene-3,5-dione, 4-(4-METHYLQUINOLIN-8-YL)-4-AZATRICYCLO[5.2.1.0(2),?]DEC-8-ENE-3,5-DIONE, 4-(4-methylquinolin-8-yl)-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione
| Molecular Formula | C19H16N2O2 |
|---|---|
| Molecular Weight | 304.12 g/mol |
| LogP | 2.85472 |
| Topological Polar Surface Area | 50.27 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 304.1212 |
| Heavy Atoms | 23 |
| Complexity | 871.3778 |
Chemical Identifiers
| CAS Number | 5814-58-4 |
|---|---|
| SMILES | CC1=C2C=CC=C(C2=NC=C1)N3C(=O)C4C5CC(C4C3=O)C=C5 |
Product Overview
AB00098236-01 (CAS 5814-58-4), with molecular formula C19H16N2O2 and molecular weight 304.12 g/mol. IUPAC: 4-(4-methylquinolin-8-yl)-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione.
Chemical Property Profile of AB00098236-01
Property Insights of AB00098236-01
The XLogP value of 2.85472 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00098236-01. With a topological polar surface area (TPSA) of 50.27 Ų, AB00098236-01 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AB00098236-01 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 AB00098236-01?
The CAS number of AB00098236-01 is 5814-58-4.
What is the molecular formula of AB00098236-01?
The molecular formula of AB00098236-01 is C19H16N2O2.
What is the molecular weight of AB00098236-01?
The molecular weight of AB00098236-01 is 304.12 g/mol.
Where can I buy AB00098236-01?
You can request a quote for AB00098236-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00098236-01?
Yes, KEHONG BIO provides custom synthesis services for AB00098236-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.