RefChem:239372
TL;DR: RefChem:239372 (CAS 80428-98-4) is a chemical compound with molecular formula C30H34N4O7 and molecular weight 562.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxypropane-1,2,3-tricarboxylic acid;1-methyl-2-[2-(4-phenylpiperazin-1-yl)ethyl]benzo[e]benzimidazole
Also Known As: 1H-Naphth(1,2-d)imidazole, 1-methyl-2-(2-(4-phenyl-1-piperazinyl)ethyl)-, 2-hydroxy-1,2,3-propanetricarboxylate (1:1), 1H-Naphth(1,2-d)imidazole,1-methyl-2-(2-(4-phenyl-1-piperazinyl)ethyl)-,2-hydroxy-1,2,3-propanetricarboxylate (1:1), 2-hydroxypropane-1,2,3-tricarboxylic acid,1-methyl-2-[2-(4-phenylpiperazin-1-yl)ethyl]benzo[e]benzimidazole, 2-Hydroxypropane-1,2,3-tricarboxylic acid--1-methyl-2-[2-(4-phenylpiperazin-1-yl)ethyl]-1H-naphtho[1,2-d]imidazole (1/1), 2-hydroxypropane-1,2,3-tricarboxylic acid; 1-methyl-2-[2-(4-phenylpiperazin-1-yl)ethyl]benzo[e]benzimidazole
| Molecular Formula | C30H34N4O7 |
|---|---|
| Molecular Weight | 562.24 g/mol |
| LogP | 2.8427 |
| Topological Polar Surface Area | 156.43 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 562.24274 |
| Heavy Atoms | 41 |
| Complexity | 1512.185 |
Chemical Identifiers
| CAS Number | 80428-98-4 |
|---|---|
| SMILES | CN1C(=NC2=C1C3=CC=CC=C3C=C2)CCN4CCN(CC4)C5=CC=CC=C5.C(C(=O)O)C(CC(=O)O)(C(=O)O)O |
Product Overview
RefChem:239372 (CAS 80428-98-4), with molecular formula C30H34N4O7 and molecular weight 562.24 g/mol. IUPAC: 2-hydroxypropane-1,2,3-tricarboxylic acid;1-methyl-2-[2-(4-phenylpiperazin-1-yl)ethyl]benzo[e]benzimidazole.
Chemical Property Profile of RefChem:239372
Property Insights of RefChem:239372
The XLogP value of 2.8427 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:239372. The TPSA of 156.43 Ų indicates high polarity, suggesting RefChem:239372 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:239372 has 4 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 RefChem:239372?
The CAS number of RefChem:239372 is 80428-98-4.
What is the molecular formula of RefChem:239372?
The molecular formula of RefChem:239372 is C30H34N4O7.
What is the molecular weight of RefChem:239372?
The molecular weight of RefChem:239372 is 562.24 g/mol.
Where can I buy RefChem:239372?
You can request a quote for RefChem:239372 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:239372?
Yes, KEHONG BIO provides custom synthesis services for RefChem:239372 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.