(E)-2-(dimethylamino)-1,4-diphenylbut-2-ene-1,4-dione
TL;DR: (E)-2-(dimethylamino)-1,4-diphenylbut-2-ene-1,4-dione (CAS 87258-44-4) is a chemical compound with molecular formula C18H17NO2 and molecular weight 279.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-2-(dimethylamino)-1,4-diphenylbut-2-ene-1,4-dione
Also Known As: (E)-2-(dimethylamino)-1,4-diphenylbut-2-ene-1,4-dione, (2E)-2-(Dimethylamino)-1,4-diphenylbut-2-ene-1,4-dione
| Molecular Formula | C18H17NO2 |
|---|---|
| Molecular Weight | 279.13 g/mol |
| LogP | 3.1977 |
| Topological Polar Surface Area | 37.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 279.12592 |
| Heavy Atoms | 21 |
| Complexity | 658.1324 |
Chemical Identifiers
| CAS Number | 87258-44-4 |
|---|---|
| SMILES | CN(C)/C(=C/C(=O)C1=CC=CC=C1)/C(=O)C2=CC=CC=C2 |
Product Overview
(E)-2-(dimethylamino)-1,4-diphenylbut-2-ene-1,4-dione (CAS 87258-44-4), with molecular formula C18H17NO2 and molecular weight 279.13 g/mol. IUPAC: (E)-2-(dimethylamino)-1,4-diphenylbut-2-ene-1,4-dione.
Chemical Property Profile of (E)-2-(dimethylamino)-1,4-diphenylbut-2-ene-1,4-dione
Property Insights of (E)-2-(dimethylamino)-1,4-diphenylbut-2-ene-1,4-dione
The XLogP value of 3.1977 indicates that (E)-2-(dimethylamino)-1,4-diphenylbut-2-ene-1,4-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.38 Ų, (E)-2-(dimethylamino)-1,4-diphenylbut-2-ene-1,4-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-2-(dimethylamino)-1,4-diphenylbut-2-ene-1,4-dione has 0 hydrogen bond donor(s) and 3 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 (E)-2-(dimethylamino)-1,4-diphenylbut-2-ene-1,4-dione?
The CAS number of (E)-2-(dimethylamino)-1,4-diphenylbut-2-ene-1,4-dione is 87258-44-4.
What is the molecular formula of (E)-2-(dimethylamino)-1,4-diphenylbut-2-ene-1,4-dione?
The molecular formula of (E)-2-(dimethylamino)-1,4-diphenylbut-2-ene-1,4-dione is C18H17NO2.
What is the molecular weight of (E)-2-(dimethylamino)-1,4-diphenylbut-2-ene-1,4-dione?
The molecular weight of (E)-2-(dimethylamino)-1,4-diphenylbut-2-ene-1,4-dione is 279.13 g/mol.
Where can I buy (E)-2-(dimethylamino)-1,4-diphenylbut-2-ene-1,4-dione?
You can request a quote for (E)-2-(dimethylamino)-1,4-diphenylbut-2-ene-1,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-2-(dimethylamino)-1,4-diphenylbut-2-ene-1,4-dione?
Yes, KEHONG BIO provides custom synthesis services for (E)-2-(dimethylamino)-1,4-diphenylbut-2-ene-1,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.