VU0605258-1
TL;DR: VU0605258-1 (CAS 885187-67-7) is a chemical compound with molecular formula C19H17ClFN3O2S and molecular weight 405.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-2-(4-chlorophenyl)sulfonyl-3-[4-(4-fluorophenyl)piperazin-1-yl]prop-2-enenitrile
Also Known As: VU0605258-1, (E)-2-((4-chlorophenyl)sulfonyl)-3-(4-(4-fluorophenyl)piperazin-1-yl)acrylonitrile, F3225-7770, (2E)-2-(4-CHLOROBENZENESULFONYL)-3-[4-(4-FLUOROPHENYL)PIPERAZIN-1-YL]PROP-2-ENENITRILE, (E)-2-(4-chlorophenyl)sulfonyl-3-[4-(4-fluorophenyl)piperazin-1-yl]prop-2-enenitrile
| Molecular Formula | C19H17ClFN3O2S |
|---|---|
| Molecular Weight | 405.07 g/mol |
| LogP | 3.43998 |
| Topological Polar Surface Area | 64.41 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 405.0714 |
| Heavy Atoms | 27 |
| Complexity | 975.11 |
Chemical Identifiers
| CAS Number | 885187-67-7 |
|---|---|
| SMILES | C1CN(CCN1/C=C(\C#N)/S(=O)(=O)C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)F |
Product Overview
VU0605258-1 (CAS 885187-67-7), with molecular formula C19H17ClFN3O2S and molecular weight 405.07 g/mol. IUPAC: (E)-2-(4-chlorophenyl)sulfonyl-3-[4-(4-fluorophenyl)piperazin-1-yl]prop-2-enenitrile.
Chemical Property Profile of VU0605258-1
Property Insights of VU0605258-1
The XLogP value of 3.43998 indicates that VU0605258-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.41 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0605258-1. Following Lipinski's Rule of Five, VU0605258-1 has 0 hydrogen bond donor(s) and 5 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 VU0605258-1?
The CAS number of VU0605258-1 is 885187-67-7.
What is the molecular formula of VU0605258-1?
The molecular formula of VU0605258-1 is C19H17ClFN3O2S.
What is the molecular weight of VU0605258-1?
The molecular weight of VU0605258-1 is 405.07 g/mol.
Where can I buy VU0605258-1?
You can request a quote for VU0605258-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0605258-1?
Yes, KEHONG BIO provides custom synthesis services for VU0605258-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.