BAS 03086335
TL;DR: BAS 03086335 (CAS 428502-58-3) is a chemical compound with molecular formula C22H25F2N3O and molecular weight 385.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3,4-difluorophenyl)-3-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]propanamide
Also Known As: BAS 03086335, 3-(4-CINNAMYLPIPERAZINO)-N~1~-(3,4-DIFLUOROPHENYL)PROPANAMIDE, N-(3,4-Difluoro-phenyl)-3-[4-(3-phenyl-allyl)-piperazin-1-yl]-propionamide, N-(3,4-difluorophenyl)-3-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]propanamide, N-(3,4-difluorophenyl)-3-{4-[(2E)-3-phenylprop-2-en-1-yl]piperazin-1-yl}propanamide
| Molecular Formula | C22H25F2N3O |
|---|---|
| Molecular Weight | 385.20 g/mol |
| LogP | 3.6244 |
| Topological Polar Surface Area | 35.58 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 385.19656 |
| Heavy Atoms | 28 |
| Complexity | 802.6841 |
Chemical Identifiers
| CAS Number | 428502-58-3 |
|---|---|
| SMILES | C1CN(CCN1CCC(=O)NC2=CC(=C(C=C2)F)F)C/C=C/C3=CC=CC=C3 |
Product Overview
BAS 03086335 (CAS 428502-58-3), with molecular formula C22H25F2N3O and molecular weight 385.20 g/mol. IUPAC: N-(3,4-difluorophenyl)-3-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]propanamide.
Chemical Property Profile of BAS 03086335
Property Insights of BAS 03086335
The XLogP value of 3.6244 indicates that BAS 03086335 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.58 Ų, BAS 03086335 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 03086335 has 1 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 BAS 03086335?
The CAS number of BAS 03086335 is 428502-58-3.
What is the molecular formula of BAS 03086335?
The molecular formula of BAS 03086335 is C22H25F2N3O.
What is the molecular weight of BAS 03086335?
The molecular weight of BAS 03086335 is 385.20 g/mol.
Where can I buy BAS 03086335?
You can request a quote for BAS 03086335 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 03086335?
Yes, KEHONG BIO provides custom synthesis services for BAS 03086335 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.