(5E)-2-(4-benzylpiperidin-1-yl)-5-[(4-prop-2-enoxyphenyl)methylidene]-1,3-thiazol-4-one
TL;DR: (5E)-2-(4-benzylpiperidin-1-yl)-5-[(4-prop-2-enoxyphenyl)methylidene]-1,3-thiazol-4-one (CAS 519013-63-9) is a chemical compound with molecular formula C25H26N2O2S and molecular weight 418.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-2-(4-benzylpiperidin-1-yl)-5-[(4-prop-2-enoxyphenyl)methylidene]-1,3-thiazol-4-one
Also Known As: (5E)-2-(4-benzylpiperidin-1-yl)-5-[(4-prop-2-enoxyphenyl)methylidene]-1,3-thiazol-4-one, (5E)-2-(4-benzylpiperidin-1-yl)-5-[4-(prop-2-en-1-yloxy)benzylidene]-1,3-thiazol-4(5H)-one
| Molecular Formula | C25H26N2O2S |
|---|---|
| Molecular Weight | 418.17 g/mol |
| LogP | 5.1764 |
| Topological Polar Surface Area | 41.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 418.1715 |
| Heavy Atoms | 30 |
| Complexity | 942.8737 |
Chemical Identifiers
| CAS Number | 519013-63-9 |
|---|---|
| SMILES | C=CCOC1=CC=C(C=C1)/C=C/2\C(=O)N=C(S2)N3CCC(CC3)CC4=CC=CC=C4 |
Product Overview
(5E)-2-(4-benzylpiperidin-1-yl)-5-[(4-prop-2-enoxyphenyl)methylidene]-1,3-thiazol-4-one (CAS 519013-63-9), with molecular formula C25H26N2O2S and molecular weight 418.17 g/mol. IUPAC: (5E)-2-(4-benzylpiperidin-1-yl)-5-[(4-prop-2-enoxyphenyl)methylidene]-1,3-thiazol-4-one.
Chemical Property Profile of (5E)-2-(4-benzylpiperidin-1-yl)-5-[(4-prop-2-enoxyphenyl)methylidene]-1,3-thiazol-4-one
Property Insights of (5E)-2-(4-benzylpiperidin-1-yl)-5-[(4-prop-2-enoxyphenyl)methylidene]-1,3-thiazol-4-one
The XLogP value of 5.1764 indicates that (5E)-2-(4-benzylpiperidin-1-yl)-5-[(4-prop-2-enoxyphenyl)methylidene]-1,3-thiazol-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.9 Ų, (5E)-2-(4-benzylpiperidin-1-yl)-5-[(4-prop-2-enoxyphenyl)methylidene]-1,3-thiazol-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (5E)-2-(4-benzylpiperidin-1-yl)-5-[(4-prop-2-enoxyphenyl)methylidene]-1,3-thiazol-4-one has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (5E)-2-(4-benzylpiperidin-1-yl)-5-[(4-prop-2-enoxyphenyl)methylidene]-1,3-thiazol-4-one?
The CAS number of (5E)-2-(4-benzylpiperidin-1-yl)-5-[(4-prop-2-enoxyphenyl)methylidene]-1,3-thiazol-4-one is 519013-63-9.
What is the molecular formula of (5E)-2-(4-benzylpiperidin-1-yl)-5-[(4-prop-2-enoxyphenyl)methylidene]-1,3-thiazol-4-one?
The molecular formula of (5E)-2-(4-benzylpiperidin-1-yl)-5-[(4-prop-2-enoxyphenyl)methylidene]-1,3-thiazol-4-one is C25H26N2O2S.
What is the molecular weight of (5E)-2-(4-benzylpiperidin-1-yl)-5-[(4-prop-2-enoxyphenyl)methylidene]-1,3-thiazol-4-one?
The molecular weight of (5E)-2-(4-benzylpiperidin-1-yl)-5-[(4-prop-2-enoxyphenyl)methylidene]-1,3-thiazol-4-one is 418.17 g/mol.
Where can I buy (5E)-2-(4-benzylpiperidin-1-yl)-5-[(4-prop-2-enoxyphenyl)methylidene]-1,3-thiazol-4-one?
You can request a quote for (5E)-2-(4-benzylpiperidin-1-yl)-5-[(4-prop-2-enoxyphenyl)methylidene]-1,3-thiazol-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (5E)-2-(4-benzylpiperidin-1-yl)-5-[(4-prop-2-enoxyphenyl)methylidene]-1,3-thiazol-4-one?
Yes, KEHONG BIO provides custom synthesis services for (5E)-2-(4-benzylpiperidin-1-yl)-5-[(4-prop-2-enoxyphenyl)methylidene]-1,3-thiazol-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.