RefChem:1056379
TL;DR: RefChem:1056379 (CAS 60960-20-5) is a chemical compound with molecular formula C35H43N5O11 and molecular weight 709.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis((E)-but-2-enedioic acid);2-[4-[[1-[3-(3-methoxyphenyl)-3-oxopropyl]benzimidazol-2-yl]methyl]-3-propan-2-ylpiperazin-1-yl]acetamide
Also Known As: 1-Piperazineacetamide, 4-((1-(3-(3-methoxyphenyl)-3-oxopropyl)-1H-benzimidazol-2-yl)methyl)-N-(1-methylethyl)-, (Z)-2-butenedioate (1:2), (E)-but-2-enedioic acid; 2-[4-[[1-[3-(3-methoxyphenyl)-3-oxopropyl]benzimidazol-2-yl]methyl]-3-propan-2-ylpiperazin-1-yl]acetamide, RefChem:1056379
| Molecular Formula | C35H43N5O11 |
|---|---|
| Molecular Weight | 709.30 g/mol |
| LogP | 2.369 |
| Topological Polar Surface Area | 242.89 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 14 |
| Exact Mass | 709.2959 |
| Heavy Atoms | 51 |
| Complexity | 1682.4727 |
Chemical Identifiers
| CAS Number | 60960-20-5 |
|---|---|
| SMILES | CC(C1N(CCN(C1)CC(=O)N)CC2=NC3=CC=CC=C3N2CCC(=O)C4=CC(=CC=C4)OC)C.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O |
Product Overview
RefChem:1056379 (CAS 60960-20-5), with molecular formula C35H43N5O11 and molecular weight 709.30 g/mol. IUPAC: bis((E)-but-2-enedioic acid);2-[4-[[1-[3-(3-methoxyphenyl)-3-oxopropyl]benzimidazol-2-yl]methyl]-3-propan-2-ylpiperazin-1-yl]acetamide.
Chemical Property Profile of RefChem:1056379
Property Insights of RefChem:1056379
The XLogP value of 2.369 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1056379. The TPSA of 242.89 Ų indicates high polarity, suggesting RefChem:1056379 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:1056379 has 5 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:1056379?
The CAS number of RefChem:1056379 is 60960-20-5.
What is the molecular formula of RefChem:1056379?
The molecular formula of RefChem:1056379 is C35H43N5O11.
What is the molecular weight of RefChem:1056379?
The molecular weight of RefChem:1056379 is 709.30 g/mol.
Where can I buy RefChem:1056379?
You can request a quote for RefChem:1056379 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1056379?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1056379 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.