J2.890.423A
TL;DR: J2.890.423A (CAS 1807796-13-9) is a chemical compound with molecular formula C23H24ClNO4 and molecular weight 413.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-4-[1-benzyl-4-[(4-chlorophenyl)methyl]piperidin-4-yl]-2-hydroxy-4-oxobut-2-enoic acid
Also Known As: J2.890.423A, L-742001, (2z)-4-[1-Benzyl-4-(4-Chlorobenzyl)piperidin-4-Yl]-2-Hydroxy-4-Oxobut-2-Enoic Acid, (2Z)-2-Hydroxy-4-oxo-4-[4-(4-chlorobenzyl)-1-benzylpiperidine-4-yl]-2-butenoic acid, (Z)-4-(1-Benzyl-4-(4-chlorobenzyl)piperidin-4-yl)-2-hydroxy-4-oxobut-2-enoic acid
| Molecular Formula | C23H24ClNO4 |
|---|---|
| Molecular Weight | 413.14 g/mol |
| LogP | 4.2605 |
| Topological Polar Surface Area | 77.84 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 413.13937 |
| Heavy Atoms | 29 |
| Complexity | 884.8537 |
Chemical Identifiers
| CAS Number | 1807796-13-9 |
|---|---|
| SMILES | C1CN(CCC1(CC2=CC=C(C=C2)Cl)C(=O)/C=C(/C(=O)O)\O)CC3=CC=CC=C3 |
Product Overview
J2.890.423A (CAS 1807796-13-9), with molecular formula C23H24ClNO4 and molecular weight 413.14 g/mol. IUPAC: (Z)-4-[1-benzyl-4-[(4-chlorophenyl)methyl]piperidin-4-yl]-2-hydroxy-4-oxobut-2-enoic acid.
Chemical Property Profile of J2.890.423A
Property Insights of J2.890.423A
The XLogP value of 4.2605 indicates that J2.890.423A 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 J2.890.423A. Following Lipinski's Rule of Five, J2.890.423A 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 J2.890.423A?
The CAS number of J2.890.423A is 1807796-13-9.
What is the molecular formula of J2.890.423A?
The molecular formula of J2.890.423A is C23H24ClNO4.
What is the molecular weight of J2.890.423A?
The molecular weight of J2.890.423A is 413.14 g/mol.
Where can I buy J2.890.423A?
You can request a quote for J2.890.423A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for J2.890.423A?
Yes, KEHONG BIO provides custom synthesis services for J2.890.423A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.