![1-[(3-Nitro-4-propoxyphenyl)methyl]imidazole structure](/static/products/1202/120286-44-4.webp)
1-[(3-Nitro-4-propoxyphenyl)methyl]imidazole
TL;DR: 1-[(3-Nitro-4-propoxyphenyl)methyl]imidazole (CAS 120286-44-4) is a chemical compound with molecular formula C13H15N3O3 and molecular weight 261.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(3-nitro-4-propoxyphenyl)methyl]imidazole
Also Known As: 1-[(3-nitro-4-propoxyphenyl)methyl]imidazole, 1-(3-Nitro-4-propoxy-benzyl)-1H-imidazole, 1-(3-nitro-4-propoxy-benzyl)imidazole, 1-(3-nitro-4-propoxybenzyl)-1H-imidazole, BAS 00288722
| Molecular Formula | C13H15N3O3 |
|---|---|
| Molecular Weight | 261.11 g/mol |
| LogP | 2.6284 |
| Topological Polar Surface Area | 70.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 261.11133 |
| Heavy Atoms | 19 |
| Complexity | 552.266 |
Chemical Identifiers
| CAS Number | 120286-44-4 |
|---|---|
| SMILES | CCCOC1=C(C=C(C=C1)CN2C=CN=C2)[N+](=O)[O-] |
Product Overview
1-[(3-Nitro-4-propoxyphenyl)methyl]imidazole (CAS 120286-44-4), with molecular formula C13H15N3O3 and molecular weight 261.11 g/mol. IUPAC: 1-[(3-nitro-4-propoxyphenyl)methyl]imidazole.
Chemical Property Profile of 1-[(3-Nitro-4-propoxyphenyl)methyl]imidazole
Property Insights of 1-[(3-Nitro-4-propoxyphenyl)methyl]imidazole
The XLogP value of 2.6284 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[(3-Nitro-4-propoxyphenyl)methyl]imidazole. The TPSA of 70.19 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[(3-Nitro-4-propoxyphenyl)methyl]imidazole. Following Lipinski's Rule of Five, 1-[(3-Nitro-4-propoxyphenyl)methyl]imidazole has 0 hydrogen bond donor(s) and 4 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 1-[(3-Nitro-4-propoxyphenyl)methyl]imidazole?
The CAS number of 1-[(3-Nitro-4-propoxyphenyl)methyl]imidazole is 120286-44-4.
What is the molecular formula of 1-[(3-Nitro-4-propoxyphenyl)methyl]imidazole?
The molecular formula of 1-[(3-Nitro-4-propoxyphenyl)methyl]imidazole is C13H15N3O3.
What is the molecular weight of 1-[(3-Nitro-4-propoxyphenyl)methyl]imidazole?
The molecular weight of 1-[(3-Nitro-4-propoxyphenyl)methyl]imidazole is 261.11 g/mol.
Where can I buy 1-[(3-Nitro-4-propoxyphenyl)methyl]imidazole?
You can request a quote for 1-[(3-Nitro-4-propoxyphenyl)methyl]imidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(3-Nitro-4-propoxyphenyl)methyl]imidazole?
Yes, KEHONG BIO provides custom synthesis services for 1-[(3-Nitro-4-propoxyphenyl)methyl]imidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.