RefChem:1058218
TL;DR: RefChem:1058218 (CAS 56825-59-3) is a chemical compound with molecular formula C25H30N2O5 and molecular weight 438.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-but-2-enedioic acid;N-[(5-methoxy-2-methyl-1-phenylindol-3-yl)methyl]butan-1-amine
Also Known As: 1H-Indole-3-methanamine, N-butyl-5-methoxy-2-methyl-1-phenyl-, (Z)-2-butenedioate (1:1), N-Butyl-5-methoxy-2-methyl-1-phenyl-1H-indole-3-methanamine (Z)-2-butenedioate (1:1), Maleate de phenyl-1 methyl-2 butylaminomethyl-3 methoxy-5 indole, Maleate de phenyl-1 methyl-2 butylaminomethyl-3 methoxy-5 indole [French], Maleate de phenyl-1 methyl-2 butylaminomethyl-3 methoxy-5 indole [French]
| Molecular Formula | C25H30N2O5 |
|---|---|
| Molecular Weight | 438.22 g/mol |
| LogP | 4.54902 |
| Topological Polar Surface Area | 100.79 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 438.21548 |
| Heavy Atoms | 32 |
| Complexity | 1054.8759 |
Chemical Identifiers
| CAS Number | 56825-59-3 |
|---|---|
| SMILES | CCCCNCC1=C(N(C2=C1C=C(C=C2)OC)C3=CC=CC=C3)C.C(=C/C(=O)O)\C(=O)O |
Product Overview
RefChem:1058218 (CAS 56825-59-3), with molecular formula C25H30N2O5 and molecular weight 438.22 g/mol. IUPAC: (E)-but-2-enedioic acid;N-[(5-methoxy-2-methyl-1-phenylindol-3-yl)methyl]butan-1-amine.
Chemical Property Profile of RefChem:1058218
Property Insights of RefChem:1058218
The XLogP value of 4.54902 indicates that RefChem:1058218 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 100.79 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1058218. Following Lipinski's Rule of Five, RefChem:1058218 has 3 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 RefChem:1058218?
The CAS number of RefChem:1058218 is 56825-59-3.
What is the molecular formula of RefChem:1058218?
The molecular formula of RefChem:1058218 is C25H30N2O5.
What is the molecular weight of RefChem:1058218?
The molecular weight of RefChem:1058218 is 438.22 g/mol.
Where can I buy RefChem:1058218?
You can request a quote for RefChem:1058218 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1058218?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1058218 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.