AB00117436-01
TL;DR: AB00117436-01 (CAS 432005-32-8) is a chemical compound with molecular formula C22H14Cl2N2O5 and molecular weight 456.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-5-[5-[(E)-[1-[(4-chlorophenyl)methyl]-2,5-dioxoimidazolidin-4-ylidene]methyl]furan-2-yl]benzoic acid
Also Known As: AB00117436-01, 2-chloro-5-(5-{(E)-[1-(4-chlorobenzyl)-2,5-dioxoimidazolidin-4-ylidene]methyl}furan-2-yl)benzoic acid, (E)-2-chloro-5-(5-((1-(4-chlorobenzyl)-2,5-dioxoimidazolidin-4-ylidene)methyl)furan-2-yl)benzoic acid, 2-CHLORO-5-(5-{[(4E)-1-[(4-CHLOROPHENYL)METHYL]-2,5-DIOXOIMIDAZOLIDIN-4-YLIDENE]METHYL}FURAN-2-YL)BENZOIC ACID, 2-chloro-5-[5-[(E)-[1-[(4-chlorophenyl)methyl]-2,5-dioxoimidazolidin-4-ylidene]methyl]furan-2-yl]benzoic acid
| Molecular Formula | C22H14Cl2N2O5 |
|---|---|
| Molecular Weight | 456.03 g/mol |
| LogP | 5.0445 |
| Topological Polar Surface Area | 99.85 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 456.02798 |
| Heavy Atoms | 31 |
| Complexity | 1230.9532 |
Chemical Identifiers
| CAS Number | 432005-32-8 |
|---|---|
| SMILES | C1=CC(=CC=C1CN2C(=O)/C(=C\C3=CC=C(O3)C4=CC(=C(C=C4)Cl)C(=O)O)/NC2=O)Cl |
Product Overview
AB00117436-01 (CAS 432005-32-8), with molecular formula C22H14Cl2N2O5 and molecular weight 456.03 g/mol. IUPAC: 2-chloro-5-[5-[(E)-[1-[(4-chlorophenyl)methyl]-2,5-dioxoimidazolidin-4-ylidene]methyl]furan-2-yl]benzoic acid.
Chemical Property Profile of AB00117436-01
Property Insights of AB00117436-01
The XLogP value of 5.0445 indicates that AB00117436-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.85 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00117436-01. Following Lipinski's Rule of Five, AB00117436-01 has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AB00117436-01?
The CAS number of AB00117436-01 is 432005-32-8.
What is the molecular formula of AB00117436-01?
The molecular formula of AB00117436-01 is C22H14Cl2N2O5.
What is the molecular weight of AB00117436-01?
The molecular weight of AB00117436-01 is 456.03 g/mol.
Where can I buy AB00117436-01?
You can request a quote for AB00117436-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00117436-01?
Yes, KEHONG BIO provides custom synthesis services for AB00117436-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.