RefChem:1075363
TL;DR: RefChem:1075363 (CAS 118989-80-3) is a chemical compound with molecular formula C23H32N4O9 and molecular weight 508.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis((E)-but-2-enedioic acid);N-[4-(dimethylamino)phenyl]-2-(4-methylpiperazin-1-yl)acetamide
Also Known As: N-(4-Dimethylaminophenyl)-2-(4-methyl-1-piperazinyl)acetamide dimaleate hemihydrate, Acetamide, N-(4-(dimethylamino)phenyl)-2-(4-methyl-1-piperazinyl)-, (Z)-2-butenedioate, hydrate (2:4:1), 1-Piperazineacetamide, N-(4-(dimethylamino)phenyl)-4-methyl-, (Z)-2-butenedioate (1:2), 1/2H2O, (E)-but-2-enedioic acid; N-(4-dimethylaminophenyl)-2-(4-methylpiperazin-1-yl)acetamide
| Molecular Formula | C23H32N4O9 |
|---|---|
| Molecular Weight | 508.22 g/mol |
| LogP | 0.3621 |
| Topological Polar Surface Area | 188.02 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 508.21692 |
| Heavy Atoms | 36 |
| Complexity | 869.40765 |
Chemical Identifiers
| CAS Number | 118989-80-3 |
|---|---|
| SMILES | CN1CCN(CC1)CC(=O)NC2=CC=C(C=C2)N(C)C.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O |
Product Overview
RefChem:1075363 (CAS 118989-80-3), with molecular formula C23H32N4O9 and molecular weight 508.22 g/mol. IUPAC: bis((E)-but-2-enedioic acid);N-[4-(dimethylamino)phenyl]-2-(4-methylpiperazin-1-yl)acetamide.
Chemical Property Profile of RefChem:1075363
Property Insights of RefChem:1075363
The XLogP value of 0.3621 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1075363. The TPSA of 188.02 Ų indicates high polarity, suggesting RefChem:1075363 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:1075363 has 5 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:1075363?
The CAS number of RefChem:1075363 is 118989-80-3.
What is the molecular formula of RefChem:1075363?
The molecular formula of RefChem:1075363 is C23H32N4O9.
What is the molecular weight of RefChem:1075363?
The molecular weight of RefChem:1075363 is 508.22 g/mol.
Where can I buy RefChem:1075363?
You can request a quote for RefChem:1075363 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1075363?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1075363 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.