C16H11Cl3N4
TL;DR: C16H11Cl3N4 (CAS 185422-39-3) is a chemical compound with molecular formula C16H11Cl3N4 and molecular weight 364.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-chlorophenyl)-1-[(E)-(2,4-dichlorophenyl)methylideneamino]imidazol-2-amine
Also Known As: (E)-4-(4-chlorophenyl)-N1-(2,4-dichlorobenzylidene)-1H-imidazole-1,2-diamine, 4-(4-chlorophenyl)-N~1~-[(E)-(2,4-dichlorophenyl)methylidene]-1H-imidazole-1,2-diamine, (1E)-4-(4-CHLOROPHENYL)-N1-[(2,4-DICHLOROPHENYL)METHYLIDENE]-1H-IMIDAZOLE-1,2-DIAMINE
| Molecular Formula | C16H11Cl3N4 |
|---|---|
| Molecular Weight | 364.00 g/mol |
| LogP | 4.9747 |
| Topological Polar Surface Area | 56.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 364.00494 |
| Heavy Atoms | 23 |
| Complexity | 869.5319 |
Chemical Identifiers
| CAS Number | 185422-39-3 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=CN(C(=N2)N)/N=C/C3=C(C=C(C=C3)Cl)Cl)Cl |
Product Overview
C16H11Cl3N4 (CAS 185422-39-3), with molecular formula C16H11Cl3N4 and molecular weight 364.00 g/mol. IUPAC: 4-(4-chlorophenyl)-1-[(E)-(2,4-dichlorophenyl)methylideneamino]imidazol-2-amine.
Chemical Property Profile of C16H11Cl3N4
Property Insights of C16H11Cl3N4
The XLogP value of 4.9747 indicates that C16H11Cl3N4 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.2 Ų, C16H11Cl3N4 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, C16H11Cl3N4 has 1 hydrogen bond donor(s) and 3 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 C16H11Cl3N4?
The CAS number of C16H11Cl3N4 is 185422-39-3.
What is the molecular formula of C16H11Cl3N4?
The molecular formula of C16H11Cl3N4 is C16H11Cl3N4.
What is the molecular weight of C16H11Cl3N4?
The molecular weight of C16H11Cl3N4 is 364.00 g/mol.
Where can I buy C16H11Cl3N4?
You can request a quote for C16H11Cl3N4 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C16H11Cl3N4?
Yes, KEHONG BIO provides custom synthesis services for C16H11Cl3N4 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.