BCPA
TL;DR: BCPA (CAS 547731-67-9) is a chemical compound with molecular formula C22H22Cl2N2O2 and molecular weight 416.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-(2-chlorophenyl)-N-[4-[[(E)-3-(2-chlorophenyl)prop-2-enoyl]amino]butyl]prop-2-enamide
Also Known As: BCPA, BCPA?, (E)-3-(2-chlorophenyl)-N-[4-[[(E)-3-(2-chlorophenyl)prop-2-enoyl]amino]butyl]prop-2-enamide, 3-(2-chlorophenyl)-N-(4-{[3-(2-chlorophenyl)acryloyl]amino}butyl)acrylamide, (2E,2'E)-N,N'-butane-1,4-diylbis[3-(2-chlorophenyl)prop-2-enamide]
| Molecular Formula | C22H22Cl2N2O2 |
|---|---|
| Molecular Weight | 416.11 g/mol |
| LogP | 4.7326 |
| Topological Polar Surface Area | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 9 |
| Exact Mass | 416.10583 |
| Heavy Atoms | 28 |
| Complexity | 791.6202 |
Chemical Identifiers
| CAS Number | 547731-67-9 |
|---|---|
| SMILES | C1=CC=C(C(=C1)/C=C/C(=O)NCCCCNC(=O)/C=C/C2=CC=CC=C2Cl)Cl |
Product Overview
BCPA (CAS 547731-67-9), with molecular formula C22H22Cl2N2O2 and molecular weight 416.11 g/mol. IUPAC: (E)-3-(2-chlorophenyl)-N-[4-[[(E)-3-(2-chlorophenyl)prop-2-enoyl]amino]butyl]prop-2-enamide.
Chemical Property Profile of BCPA
Property Insights of BCPA
The XLogP value of 4.7326 indicates that BCPA is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.2 Ų, BCPA exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BCPA has 2 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 BCPA?
The CAS number of BCPA is 547731-67-9.
What is the molecular formula of BCPA?
The molecular formula of BCPA is C22H22Cl2N2O2.
What is the molecular weight of BCPA?
The molecular weight of BCPA is 416.11 g/mol.
Where can I buy BCPA?
You can request a quote for BCPA directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BCPA?
Yes, KEHONG BIO provides custom synthesis services for BCPA and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.