RefChem:1078464
TL;DR: RefChem:1078464 (CAS 79306-68-6) is a chemical compound with molecular formula C28H31NO6 and molecular weight 477.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-dimethyl-2-phenylethanamine;(E)-2-[(2-phenylmethoxyphenoxy)methyl]but-2-enedioic acid
Also Known As: N,N-Dimethyl-beta-((2-(phenylmethoxy)phenoxy)methyl)benzeneethanamine maleate, Benzeneethanamine, N,N-dimethyl-beta-((2-(phenylmethoxy)phenoxy)methyl)-, (Z)-2-butenedioate (1:1), N,N-dimethyl-2-phenylethanamine; (E)-2-[(2-phenylmethoxyphenoxy)methyl]but-2-enedioic acid, RefChem:1078464
| Molecular Formula | C28H31NO6 |
|---|---|
| Molecular Weight | 477.22 g/mol |
| LogP | 4.5307 |
| Topological Polar Surface Area | 96.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 11 |
| Exact Mass | 477.21515 |
| Heavy Atoms | 35 |
| Complexity | 1080.8712 |
Chemical Identifiers
| CAS Number | 79306-68-6 |
|---|---|
| SMILES | CN(C)CCC1=CC=CC=C1.C1=CC=C(C=C1)COC2=CC=CC=C2OC/C(=C\C(=O)O)/C(=O)O |
Product Overview
RefChem:1078464 (CAS 79306-68-6), with molecular formula C28H31NO6 and molecular weight 477.22 g/mol. IUPAC: N,N-dimethyl-2-phenylethanamine;(E)-2-[(2-phenylmethoxyphenoxy)methyl]but-2-enedioic acid.
Chemical Property Profile of RefChem:1078464
Property Insights of RefChem:1078464
The XLogP value of 4.5307 indicates that RefChem:1078464 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.3 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1078464. Following Lipinski's Rule of Five, RefChem:1078464 has 2 hydrogen bond donor(s) and 5 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:1078464?
The CAS number of RefChem:1078464 is 79306-68-6.
What is the molecular formula of RefChem:1078464?
The molecular formula of RefChem:1078464 is C28H31NO6.
What is the molecular weight of RefChem:1078464?
The molecular weight of RefChem:1078464 is 477.22 g/mol.
Where can I buy RefChem:1078464?
You can request a quote for RefChem:1078464 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1078464?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1078464 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.