J3.584.419H
TL;DR: J3.584.419H (CAS 107070-67-7) is a chemical compound with molecular formula C20H19NO4 and molecular weight 337.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(6-hydroxy-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8-triene-7-carbonyl)benzoic acid
Also Known As: J3.584.419H, 2-(8-Hydroxy-2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinoline-9-carbonyl)benzoic acid, 2-(8-Hydroxy-1,2,3,5,6,7-hexahydropyrido[3,2,1-ij]quinoline-9-carbonyl)benzoic Acid, 2-(8-Hydroxy-2,3,6,7-tetrahydro-1H,5H-benzo[ij]quinolizine-9-yl)carbonylbenzoic acid, 2-{6-hydroxy-1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-triene-7-carbonyl}benzoic acid
| Molecular Formula | C20H19NO4 |
|---|---|
| Molecular Weight | 337.13 g/mol |
| LogP | 3.0202 |
| Topological Polar Surface Area | 77.84 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 337.1314 |
| Heavy Atoms | 25 |
| Complexity | 885.5052 |
Chemical Identifiers
| CAS Number | 107070-67-7 |
|---|---|
| SMILES | C1CC2=CC(=C(C3=C2N(C1)CCC3)O)C(=O)C4=CC=CC=C4C(=O)O |
Product Overview
J3.584.419H (CAS 107070-67-7), with molecular formula C20H19NO4 and molecular weight 337.13 g/mol. IUPAC: 2-(6-hydroxy-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8-triene-7-carbonyl)benzoic acid.
Chemical Property Profile of J3.584.419H
Property Insights of J3.584.419H
The XLogP value of 3.0202 indicates that J3.584.419H is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.84 Ų falls within the moderate polarity range, balancing permeability and solubility for J3.584.419H. Following Lipinski's Rule of Five, J3.584.419H has 2 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 J3.584.419H?
The CAS number of J3.584.419H is 107070-67-7.
What is the molecular formula of J3.584.419H?
The molecular formula of J3.584.419H is C20H19NO4.
What is the molecular weight of J3.584.419H?
The molecular weight of J3.584.419H is 337.13 g/mol.
Where can I buy J3.584.419H?
You can request a quote for J3.584.419H directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for J3.584.419H?
Yes, KEHONG BIO provides custom synthesis services for J3.584.419H and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.