tris(p-nitrophenyl)methyl bromide
TL;DR: tris(p-nitrophenyl)methyl bromide (CAS 383899-16-9) is a chemical compound with molecular formula C20H25N5 and molecular weight 335.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[3-(dimethylamino)propylamino]-2-ethyl-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile
Also Known As: tris(p-nitrophenyl)methyl bromide, BAS 08138870, UPCMLD0ENAT5747460:001, 1-((3-(dimethylamino)propyl)amino)-2-ethyl-3-methylbenzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile, 1-{[3-(dimethylamino)propyl]amino}-2-ethyl-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile
| Molecular Formula | C20H25N5 |
|---|---|
| Molecular Weight | 335.21 g/mol |
| LogP | 3.5936 |
| Topological Polar Surface Area | 56.36 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 335.211 |
| Heavy Atoms | 25 |
| Complexity | 946.26056 |
Chemical Identifiers
| CAS Number | 383899-16-9 |
|---|---|
| SMILES | CCC1=C(N2C3=CC=CC=C3N=C2C(=C1C)C#N)NCCCN(C)C |
Product Overview
tris(p-nitrophenyl)methyl bromide (CAS 383899-16-9), with molecular formula C20H25N5 and molecular weight 335.21 g/mol. IUPAC: 1-[3-(dimethylamino)propylamino]-2-ethyl-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile.
Chemical Property Profile of tris(p-nitrophenyl)methyl bromide
Property Insights of tris(p-nitrophenyl)methyl bromide
The XLogP value of 3.5936 indicates that tris(p-nitrophenyl)methyl bromide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.36 Ų, tris(p-nitrophenyl)methyl bromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, tris(p-nitrophenyl)methyl bromide has 1 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 tris(p-nitrophenyl)methyl bromide?
The CAS number of tris(p-nitrophenyl)methyl bromide is 383899-16-9.
What is the molecular formula of tris(p-nitrophenyl)methyl bromide?
The molecular formula of tris(p-nitrophenyl)methyl bromide is C20H25N5.
What is the molecular weight of tris(p-nitrophenyl)methyl bromide?
The molecular weight of tris(p-nitrophenyl)methyl bromide is 335.21 g/mol.
Where can I buy tris(p-nitrophenyl)methyl bromide?
You can request a quote for tris(p-nitrophenyl)methyl bromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for tris(p-nitrophenyl)methyl bromide?
Yes, KEHONG BIO provides custom synthesis services for tris(p-nitrophenyl)methyl bromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.