RefChem:1057997
TL;DR: RefChem:1057997 (CAS 73043-46-6) is a chemical compound with molecular formula C34H42N6O8 and molecular weight 662.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(3-[(4E)-4-[(4-methoxyphenyl)methylidene]-2-methyl-5-oxoimidazol-1-yl]propanoic acid);piperazine
Also Known As: 1H-Imidazole-1-propanoic acid, 4,5-dihydro-4-((4-methoxyphenyl)methylene)-2-methyl-5-oxo-, compd. with piperazine (2:1), 3-[(4E)-4-[(4-methoxyphenyl)methylidene]-2-methyl-5-oxo-imidazol-1-yl]propanoic Acid; Piperazine, 3-[(4E)-4-[(4-methoxyphenyl)methylidene]-2-methyl-5-oxoimidazol-1-yl]propanoic acid; piperazine, RefChem:1057997
| Molecular Formula | C34H42N6O8 |
|---|---|
| Molecular Weight | 662.31 g/mol |
| LogP | 2.722 |
| Topological Polar Surface Area | 182.46 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 10 |
| Exact Mass | 662.3064 |
| Heavy Atoms | 48 |
| Complexity | 1437.8265 |
Chemical Identifiers
| CAS Number | 73043-46-6 |
|---|---|
| SMILES | CC1=N/C(=C/C2=CC=C(C=C2)OC)/C(=O)N1CCC(=O)O.CC1=N/C(=C/C2=CC=C(C=C2)OC)/C(=O)N1CCC(=O)O.C1NCCNC1 |
Product Overview
RefChem:1057997 (CAS 73043-46-6), with molecular formula C34H42N6O8 and molecular weight 662.31 g/mol. IUPAC: bis(3-[(4E)-4-[(4-methoxyphenyl)methylidene]-2-methyl-5-oxoimidazol-1-yl]propanoic acid);piperazine.
Chemical Property Profile of RefChem:1057997
Property Insights of RefChem:1057997
The XLogP value of 2.722 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1057997. The TPSA of 182.46 Ų indicates high polarity, suggesting RefChem:1057997 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:1057997 has 4 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:1057997?
The CAS number of RefChem:1057997 is 73043-46-6.
What is the molecular formula of RefChem:1057997?
The molecular formula of RefChem:1057997 is C34H42N6O8.
What is the molecular weight of RefChem:1057997?
The molecular weight of RefChem:1057997 is 662.31 g/mol.
Where can I buy RefChem:1057997?
You can request a quote for RefChem:1057997 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1057997?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1057997 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.