AB00086010-01
TL;DR: AB00086010-01 (CAS 299407-26-4) is a chemical compound with molecular formula C19H20INO3 and molecular weight 437.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(2-iodophenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Also Known As: AB00086010-01, ethyl 4-(2-iodophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, ethyl 4-(2-iodophenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate, ethyl 4-(2-iodophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate, ethyl 4-(2-iodophenyl)-2-methyl-5-oxo-1,4,6,7,8-pentahydroquinoline-3-carboxyl ate
| Molecular Formula | C19H20INO3 |
|---|---|
| Molecular Weight | 437.05 g/mol |
| LogP | 3.8222 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 437.0488 |
| Heavy Atoms | 24 |
| Complexity | 763.6303 |
Chemical Identifiers
| CAS Number | 299407-26-4 |
|---|---|
| SMILES | CCOC(=O)C1=C(NC2=C(C1C3=CC=CC=C3I)C(=O)CCC2)C |
Product Overview
AB00086010-01 (CAS 299407-26-4), with molecular formula C19H20INO3 and molecular weight 437.05 g/mol. IUPAC: ethyl 4-(2-iodophenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate.
Chemical Property Profile of AB00086010-01
Property Insights of AB00086010-01
The XLogP value of 3.8222 indicates that AB00086010-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, AB00086010-01 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AB00086010-01 has 1 hydrogen bond donor(s) and 4 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 AB00086010-01?
The CAS number of AB00086010-01 is 299407-26-4.
What is the molecular formula of AB00086010-01?
The molecular formula of AB00086010-01 is C19H20INO3.
What is the molecular weight of AB00086010-01?
The molecular weight of AB00086010-01 is 437.05 g/mol.
Where can I buy AB00086010-01?
You can request a quote for AB00086010-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00086010-01?
Yes, KEHONG BIO provides custom synthesis services for AB00086010-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.