RefChem:1059859
TL;DR: RefChem:1059859 (CAS 62452-10-2) is a chemical compound with molecular formula C18H16ClN5O4 and molecular weight 401.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-[3-[(E)-[5-(4-cyanophenyl)furan-2-yl]methylideneamino]-2,5-dioxoimidazolidin-1-yl]-3-oxopropyl]azanium chloride
Also Known As: 2,4-Imidazolidinedione, 3-(3-amino-1-oxopropyl)-1-(((5-(4-cyanophenyl)-2-furanyl)methylene)amino)-, monohydrochloride, 2,4-IMIDAZOLIDINEDIONE, 3-(3-AMINO-1-OXOPROPYL)-1-(((5-(4-CYANOPHENYL)-2-FURANYL, RefChem:1059859
| Molecular Formula | C18H16ClN5O4 |
|---|---|
| Molecular Weight | 401.09 g/mol |
| LogP | -2.42102 |
| Topological Polar Surface Area | 134.62 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 401.08908 |
| Heavy Atoms | 28 |
| Complexity | 961.1007 |
Chemical Identifiers
| CAS Number | 62452-10-2 |
|---|---|
| SMILES | C1C(=O)N(C(=O)N1/N=C/C2=CC=C(O2)C3=CC=C(C=C3)C#N)C(=O)CC[NH3+].[Cl-] |
Product Overview
RefChem:1059859 (CAS 62452-10-2), with molecular formula C18H16ClN5O4 and molecular weight 401.09 g/mol. IUPAC: [3-[3-[(E)-[5-(4-cyanophenyl)furan-2-yl]methylideneamino]-2,5-dioxoimidazolidin-1-yl]-3-oxopropyl]azanium chloride.
Chemical Property Profile of RefChem:1059859
Property Insights of RefChem:1059859
The XLogP value of -2.42102 indicates that RefChem:1059859 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 134.62 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1059859. Following Lipinski's Rule of Five, RefChem:1059859 has 1 hydrogen bond donor(s) and 6 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 RefChem:1059859?
The CAS number of RefChem:1059859 is 62452-10-2.
What is the molecular formula of RefChem:1059859?
The molecular formula of RefChem:1059859 is C18H16ClN5O4.
What is the molecular weight of RefChem:1059859?
The molecular weight of RefChem:1059859 is 401.09 g/mol.
Where can I buy RefChem:1059859?
You can request a quote for RefChem:1059859 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1059859?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1059859 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.