(E)-1-(1-adamantyl)-3-(2-methoxyphenyl)prop-2-en-1-one
TL;DR: (E)-1-(1-adamantyl)-3-(2-methoxyphenyl)prop-2-en-1-one (CAS 351366-19-3) is a chemical compound with molecular formula C20H24O2 and molecular weight 296.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-1-(1-adamantyl)-3-(2-methoxyphenyl)prop-2-en-1-one
Also Known As: BAS 02557642, AB00285615-03, 1-Adamantan-1-yl-3-(2-methoxy-phenyl)-propenone, (E)-1-(1-adamantyl)-3-(2-methoxyphenyl)prop-2-en-1-one, (2E)-1-adamantanyl-3-(2-methoxyphenyl)prop-2-en-1-one
| Molecular Formula | C20H24O2 |
|---|---|
| Molecular Weight | 296.18 g/mol |
| LogP | 4.4939 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 296.17764 |
| Heavy Atoms | 22 |
| Complexity | 578.604 |
Chemical Identifiers
| CAS Number | 351366-19-3 |
|---|---|
| SMILES | COC1=CC=CC=C1/C=C/C(=O)C23CC4CC(C2)CC(C4)C3 |
Product Overview
(E)-1-(1-adamantyl)-3-(2-methoxyphenyl)prop-2-en-1-one (CAS 351366-19-3), with molecular formula C20H24O2 and molecular weight 296.18 g/mol. IUPAC: (E)-1-(1-adamantyl)-3-(2-methoxyphenyl)prop-2-en-1-one.
Chemical Property Profile of (E)-1-(1-adamantyl)-3-(2-methoxyphenyl)prop-2-en-1-one
Property Insights of (E)-1-(1-adamantyl)-3-(2-methoxyphenyl)prop-2-en-1-one
The XLogP value of 4.4939 indicates that (E)-1-(1-adamantyl)-3-(2-methoxyphenyl)prop-2-en-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, (E)-1-(1-adamantyl)-3-(2-methoxyphenyl)prop-2-en-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-1-(1-adamantyl)-3-(2-methoxyphenyl)prop-2-en-1-one has 0 hydrogen bond donor(s) and 2 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)-1-(1-adamantyl)-3-(2-methoxyphenyl)prop-2-en-1-one?
The CAS number of (E)-1-(1-adamantyl)-3-(2-methoxyphenyl)prop-2-en-1-one is 351366-19-3.
What is the molecular formula of (E)-1-(1-adamantyl)-3-(2-methoxyphenyl)prop-2-en-1-one?
The molecular formula of (E)-1-(1-adamantyl)-3-(2-methoxyphenyl)prop-2-en-1-one is C20H24O2.
What is the molecular weight of (E)-1-(1-adamantyl)-3-(2-methoxyphenyl)prop-2-en-1-one?
The molecular weight of (E)-1-(1-adamantyl)-3-(2-methoxyphenyl)prop-2-en-1-one is 296.18 g/mol.
Where can I buy (E)-1-(1-adamantyl)-3-(2-methoxyphenyl)prop-2-en-1-one?
You can request a quote for (E)-1-(1-adamantyl)-3-(2-methoxyphenyl)prop-2-en-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-1-(1-adamantyl)-3-(2-methoxyphenyl)prop-2-en-1-one?
Yes, KEHONG BIO provides custom synthesis services for (E)-1-(1-adamantyl)-3-(2-methoxyphenyl)prop-2-en-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.