1-(5-(Benzyloxy)-2,4-dichlorophenyl)-5-(4-nitrophenyl)-1H-1,2,3,4-tetraazole
TL;DR: 1-(5-(Benzyloxy)-2,4-dichlorophenyl)-5-(4-nitrophenyl)-1H-1,2,3,4-tetraazole (CAS 338961-49-2) is a chemical compound with molecular formula C20H13Cl2N5O3 and molecular weight 441.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,4-dichloro-5-phenylmethoxyphenyl)-5-(4-nitrophenyl)tetrazole
Also Known As: 5L-616S, 1-(2,4-dichloro-5-phenylmethoxyphenyl)-5-(4-nitrophenyl)tetrazole, 1-(5-(Benzyloxy)-2,4-dichlorophenyl)-5-(4-nitrophenyl)-1H-1,2,3,4-tetraazole, 1-(2,4-dichloro-5-phenylmethoxy-phenyl)-5-(4-nitrophenyl)tetrazole, 1-[5-(benzyloxy)-2,4-dichlorophenyl]-5-(4-nitrophenyl)-1H-1,2,3,4-tetraazole
| Molecular Formula | C20H13Cl2N5O3 |
|---|---|
| Molecular Weight | 441.04 g/mol |
| LogP | 5.1233 |
| Topological Polar Surface Area | 95.97 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 441.03955 |
| Heavy Atoms | 30 |
| Complexity | 1197.0548 |
Chemical Identifiers
| CAS Number | 338961-49-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC2=C(C=C(C(=C2)N3C(=NN=N3)C4=CC=C(C=C4)[N+](=O)[O-])Cl)Cl |
Product Overview
1-(5-(Benzyloxy)-2,4-dichlorophenyl)-5-(4-nitrophenyl)-1H-1,2,3,4-tetraazole (CAS 338961-49-2), with molecular formula C20H13Cl2N5O3 and molecular weight 441.04 g/mol. IUPAC: 1-(2,4-dichloro-5-phenylmethoxyphenyl)-5-(4-nitrophenyl)tetrazole.
Chemical Property Profile of 1-(5-(Benzyloxy)-2,4-dichlorophenyl)-5-(4-nitrophenyl)-1H-1,2,3,4-tetraazole
Property Insights of 1-(5-(Benzyloxy)-2,4-dichlorophenyl)-5-(4-nitrophenyl)-1H-1,2,3,4-tetraazole
The XLogP value of 5.1233 indicates that 1-(5-(Benzyloxy)-2,4-dichlorophenyl)-5-(4-nitrophenyl)-1H-1,2,3,4-tetraazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.97 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(5-(Benzyloxy)-2,4-dichlorophenyl)-5-(4-nitrophenyl)-1H-1,2,3,4-tetraazole. Following Lipinski's Rule of Five, 1-(5-(Benzyloxy)-2,4-dichlorophenyl)-5-(4-nitrophenyl)-1H-1,2,3,4-tetraazole has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(5-(Benzyloxy)-2,4-dichlorophenyl)-5-(4-nitrophenyl)-1H-1,2,3,4-tetraazole?
The CAS number of 1-(5-(Benzyloxy)-2,4-dichlorophenyl)-5-(4-nitrophenyl)-1H-1,2,3,4-tetraazole is 338961-49-2.
What is the molecular formula of 1-(5-(Benzyloxy)-2,4-dichlorophenyl)-5-(4-nitrophenyl)-1H-1,2,3,4-tetraazole?
The molecular formula of 1-(5-(Benzyloxy)-2,4-dichlorophenyl)-5-(4-nitrophenyl)-1H-1,2,3,4-tetraazole is C20H13Cl2N5O3.
What is the molecular weight of 1-(5-(Benzyloxy)-2,4-dichlorophenyl)-5-(4-nitrophenyl)-1H-1,2,3,4-tetraazole?
The molecular weight of 1-(5-(Benzyloxy)-2,4-dichlorophenyl)-5-(4-nitrophenyl)-1H-1,2,3,4-tetraazole is 441.04 g/mol.
Where can I buy 1-(5-(Benzyloxy)-2,4-dichlorophenyl)-5-(4-nitrophenyl)-1H-1,2,3,4-tetraazole?
You can request a quote for 1-(5-(Benzyloxy)-2,4-dichlorophenyl)-5-(4-nitrophenyl)-1H-1,2,3,4-tetraazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(5-(Benzyloxy)-2,4-dichlorophenyl)-5-(4-nitrophenyl)-1H-1,2,3,4-tetraazole?
Yes, KEHONG BIO provides custom synthesis services for 1-(5-(Benzyloxy)-2,4-dichlorophenyl)-5-(4-nitrophenyl)-1H-1,2,3,4-tetraazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.