(E)-4-bromo-2-(3-(p-tolyl)acryloyl)phenyl morpholine-4-carboxylate
TL;DR: (E)-4-bromo-2-(3-(p-tolyl)acryloyl)phenyl morpholine-4-carboxylate (CAS 433307-05-2) is a chemical compound with molecular formula C21H20BrNO4 and molecular weight 429.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-bromo-2-[(E)-3-(4-methylphenyl)prop-2-enoyl]phenyl] morpholine-4-carboxylate
Also Known As: AF-399/41127271, (E)-4-bromo-2-(3-(p-tolyl)acryloyl)phenyl morpholine-4-carboxylate, 4-bromo-2-[3-(4-methylphenyl)acryloyl]phenyl 4-morpholinecarboxylate, [4-bromo-2-[(E)-3-(4-methylphenyl)prop-2-enoyl]phenyl] morpholine-4-carboxylate, 2-[(2E)-3-(4-methylphenyl)prop-2-enoyl]-4-bromophenyl morpholine-4-carboxylate
| Molecular Formula | C21H20BrNO4 |
|---|---|
| Molecular Weight | 429.06 g/mol |
| LogP | 4.48462 |
| Topological Polar Surface Area | 55.84 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 429.05756 |
| Heavy Atoms | 27 |
| Complexity | 854.98535 |
Chemical Identifiers
| CAS Number | 433307-05-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)/C=C/C(=O)C2=C(C=CC(=C2)Br)OC(=O)N3CCOCC3 |
Product Overview
(E)-4-bromo-2-(3-(p-tolyl)acryloyl)phenyl morpholine-4-carboxylate (CAS 433307-05-2), with molecular formula C21H20BrNO4 and molecular weight 429.06 g/mol. IUPAC: [4-bromo-2-[(E)-3-(4-methylphenyl)prop-2-enoyl]phenyl] morpholine-4-carboxylate.
Chemical Property Profile of (E)-4-bromo-2-(3-(p-tolyl)acryloyl)phenyl morpholine-4-carboxylate
Property Insights of (E)-4-bromo-2-(3-(p-tolyl)acryloyl)phenyl morpholine-4-carboxylate
The XLogP value of 4.48462 indicates that (E)-4-bromo-2-(3-(p-tolyl)acryloyl)phenyl morpholine-4-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.84 Ų, (E)-4-bromo-2-(3-(p-tolyl)acryloyl)phenyl morpholine-4-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-4-bromo-2-(3-(p-tolyl)acryloyl)phenyl morpholine-4-carboxylate has 0 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 (E)-4-bromo-2-(3-(p-tolyl)acryloyl)phenyl morpholine-4-carboxylate?
The CAS number of (E)-4-bromo-2-(3-(p-tolyl)acryloyl)phenyl morpholine-4-carboxylate is 433307-05-2.
What is the molecular formula of (E)-4-bromo-2-(3-(p-tolyl)acryloyl)phenyl morpholine-4-carboxylate?
The molecular formula of (E)-4-bromo-2-(3-(p-tolyl)acryloyl)phenyl morpholine-4-carboxylate is C21H20BrNO4.
What is the molecular weight of (E)-4-bromo-2-(3-(p-tolyl)acryloyl)phenyl morpholine-4-carboxylate?
The molecular weight of (E)-4-bromo-2-(3-(p-tolyl)acryloyl)phenyl morpholine-4-carboxylate is 429.06 g/mol.
Where can I buy (E)-4-bromo-2-(3-(p-tolyl)acryloyl)phenyl morpholine-4-carboxylate?
You can request a quote for (E)-4-bromo-2-(3-(p-tolyl)acryloyl)phenyl morpholine-4-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-4-bromo-2-(3-(p-tolyl)acryloyl)phenyl morpholine-4-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for (E)-4-bromo-2-(3-(p-tolyl)acryloyl)phenyl morpholine-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.