RefChem:424665
TL;DR: RefChem:424665 (CAS 478250-82-7) is a chemical compound with molecular formula C25H19ClN8O3 and molecular weight 514.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-amino-1,2,5-oxadiazol-3-yl)-N-[(E)-[4-[(4-chlorophenyl)methoxy]phenyl]methylideneamino]-5-phenyltriazole-4-carboxamide
Also Known As: 1-(4-AMINO-1,2,5-OXADIAZOL-3-YL)-N'-((E)-{4-[(4-CHLOROBENZYL)OXY]PHENYL}METHYLIDENE)-4-PHENYL-1H-1,2,3-TRIAZOLE-5-CARBOHYDRAZIDE, 1-(4-Amino-1,2,5-oxadiazol-3-YL)-N'-((E)-(4-((4-chlorobenzyl)oxy)phenyl)methylidene)-4-phenyl-1H-1,2,3-triazole-5-carbohydrazide, 631-867-9, RefChem:424665
| Molecular Formula | C25H19ClN8O3 |
|---|---|
| Molecular Weight | 514.13 g/mol |
| LogP | 3.8958 |
| Topological Polar Surface Area | 146.34 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 8 |
| Exact Mass | 514.1269 |
| Heavy Atoms | 37 |
| Complexity | 1530.7338 |
Chemical Identifiers
| CAS Number | 478250-82-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=C(N(N=N2)C3=NON=C3N)C(=O)N/N=C/C4=CC=C(C=C4)OCC5=CC=C(C=C5)Cl |
Product Overview
RefChem:424665 (CAS 478250-82-7), with molecular formula C25H19ClN8O3 and molecular weight 514.13 g/mol. IUPAC: 3-(4-amino-1,2,5-oxadiazol-3-yl)-N-[(E)-[4-[(4-chlorophenyl)methoxy]phenyl]methylideneamino]-5-phenyltriazole-4-carboxamide.
Chemical Property Profile of RefChem:424665
Property Insights of RefChem:424665
The XLogP value of 3.8958 indicates that RefChem:424665 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 146.34 Ų indicates high polarity, suggesting RefChem:424665 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:424665 has 2 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:424665?
The CAS number of RefChem:424665 is 478250-82-7.
What is the molecular formula of RefChem:424665?
The molecular formula of RefChem:424665 is C25H19ClN8O3.
What is the molecular weight of RefChem:424665?
The molecular weight of RefChem:424665 is 514.13 g/mol.
Where can I buy RefChem:424665?
You can request a quote for RefChem:424665 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:424665?
Yes, KEHONG BIO provides custom synthesis services for RefChem:424665 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.