1H-Imidazole, 5-((2,3-dichloropropyl)thio)-2-methyl-4-nitro-1-((3-nitro-4- (pentyloxy)phenyl)methyl)-
TL;DR: 1H-Imidazole, 5-((2,3-dichloropropyl)thio)-2-methyl-4-nitro-1-((3-nitro-4- (pentyloxy)phenyl)methyl)- (CAS 115906-54-2) is a chemical compound with molecular formula C19H24Cl2N4O5S and molecular weight 490.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(2,3-dichloropropylsulfanyl)-2-methyl-4-nitro-1-[(3-nitro-4-pentoxyphenyl)methyl]imidazole
Also Known As: 1H-Imidazole, 5-((2,3-dichloropropyl)thio)-2-methyl-4-nitro-1-((3-nitro-4- (pentyloxy)phenyl)methyl)-, 1H-Imidazole, 5-((2,3-dichloropropyl)thio)-2-methyl-4-nitro-1-((3-nitro-4-(pentyloxy)phenyl)methyl)-, 5-(2,3-dichloropropylsulfanyl)-2-methyl-4-nitro-1-[(3-nitro-4-pentoxyphenyl)methyl]imidazole, 5-[(2,3-Dichloropropyl)sulfanyl]-2-methyl-4-nitro-1-{[3-nitro-4-(pentyloxy)phenyl]methyl}-1H-imidazole, BRN 5674722
| Molecular Formula | C19H24Cl2N4O5S |
|---|---|
| Molecular Weight | 490.08 g/mol |
| LogP | 5.56352 |
| Topological Polar Surface Area | 113.33 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 13 |
| Exact Mass | 490.08444 |
| Heavy Atoms | 31 |
| Complexity | 924.94336 |
Chemical Identifiers
| CAS Number | 115906-54-2 |
|---|---|
| SMILES | CCCCCOC1=C(C=C(C=C1)CN2C(=NC(=C2SCC(CCl)Cl)[N+](=O)[O-])C)[N+](=O)[O-] |
Product Overview
1H-Imidazole, 5-((2,3-dichloropropyl)thio)-2-methyl-4-nitro-1-((3-nitro-4- (pentyloxy)phenyl)methyl)- (CAS 115906-54-2), with molecular formula C19H24Cl2N4O5S and molecular weight 490.08 g/mol. IUPAC: 5-(2,3-dichloropropylsulfanyl)-2-methyl-4-nitro-1-[(3-nitro-4-pentoxyphenyl)methyl]imidazole.
Chemical Property Profile of 1H-Imidazole, 5-((2,3-dichloropropyl)thio)-2-methyl-4-nitro-1-((3-nitro-4- (pentyloxy)phenyl)methyl)-
Property Insights of 1H-Imidazole, 5-((2,3-dichloropropyl)thio)-2-methyl-4-nitro-1-((3-nitro-4- (pentyloxy)phenyl)methyl)-
The XLogP value of 5.56352 indicates that 1H-Imidazole, 5-((2,3-dichloropropyl)thio)-2-methyl-4-nitro-1-((3-nitro-4- (pentyloxy)phenyl)methyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 113.33 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-Imidazole, 5-((2,3-dichloropropyl)thio)-2-methyl-4-nitro-1-((3-nitro-4- (pentyloxy)phenyl)methyl)-. Following Lipinski's Rule of Five, 1H-Imidazole, 5-((2,3-dichloropropyl)thio)-2-methyl-4-nitro-1-((3-nitro-4- (pentyloxy)phenyl)methyl)- has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1H-Imidazole, 5-((2,3-dichloropropyl)thio)-2-methyl-4-nitro-1-((3-nitro-4- (pentyloxy)phenyl)methyl)-?
The CAS number of 1H-Imidazole, 5-((2,3-dichloropropyl)thio)-2-methyl-4-nitro-1-((3-nitro-4- (pentyloxy)phenyl)methyl)- is 115906-54-2.
What is the molecular formula of 1H-Imidazole, 5-((2,3-dichloropropyl)thio)-2-methyl-4-nitro-1-((3-nitro-4- (pentyloxy)phenyl)methyl)-?
The molecular formula of 1H-Imidazole, 5-((2,3-dichloropropyl)thio)-2-methyl-4-nitro-1-((3-nitro-4- (pentyloxy)phenyl)methyl)- is C19H24Cl2N4O5S.
What is the molecular weight of 1H-Imidazole, 5-((2,3-dichloropropyl)thio)-2-methyl-4-nitro-1-((3-nitro-4- (pentyloxy)phenyl)methyl)-?
The molecular weight of 1H-Imidazole, 5-((2,3-dichloropropyl)thio)-2-methyl-4-nitro-1-((3-nitro-4- (pentyloxy)phenyl)methyl)- is 490.08 g/mol.
Where can I buy 1H-Imidazole, 5-((2,3-dichloropropyl)thio)-2-methyl-4-nitro-1-((3-nitro-4- (pentyloxy)phenyl)methyl)-?
You can request a quote for 1H-Imidazole, 5-((2,3-dichloropropyl)thio)-2-methyl-4-nitro-1-((3-nitro-4- (pentyloxy)phenyl)methyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Imidazole, 5-((2,3-dichloropropyl)thio)-2-methyl-4-nitro-1-((3-nitro-4- (pentyloxy)phenyl)methyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Imidazole, 5-((2,3-dichloropropyl)thio)-2-methyl-4-nitro-1-((3-nitro-4- (pentyloxy)phenyl)methyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.