RefChem:404741
TL;DR: RefChem:404741 (CAS 378770-91-3) is a chemical compound with molecular formula C28H30N4O2S and molecular weight 486.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-5-[[3-(4-butoxyphenyl)-1-phenylpyrazol-4-yl]methylidene]-2-piperidin-1-yl-1,3-thiazol-4-one
Also Known As: (5Z)-5-{[3-(4-butoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylene}-2-(1-piperidinyl)-1,3-thiazol-4(5H)-one, 5-((3-(4-Butoxyphenyl)-1-phenyl-1H-pyrazol-4-yl)methylene)-2-(piperidin-1-yl)thiazol-4(5H)-one, (5Z)-5-((3-(4-Butoxyphenyl)-1-phenyl-1H-pyrazol-4-YL)methylene)-2-(1-piperidinyl)-1,3-thiazol-4(5H)-one, (5Z)-5-[[3-(4-butoxyphenyl)-1-phenylpyrazol-4-yl]methylidene]-2-piperidin-1-yl-1,3-thiazol-4-one, (5Z)-5-{[3-(4-butoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2-(piperidin-1-yl)-1,3-thiazol-4(5H)-one
| Molecular Formula | C28H30N4O2S |
|---|---|
| Molecular Weight | 486.21 g/mol |
| LogP | 6.1744 |
| Topological Polar Surface Area | 59.72 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 486.20895 |
| Heavy Atoms | 35 |
| Complexity | 1225.603 |
Chemical Identifiers
| CAS Number | 378770-91-3 |
|---|---|
| SMILES | CCCCOC1=CC=C(C=C1)C2=NN(C=C2/C=C\3/C(=O)N=C(S3)N4CCCCC4)C5=CC=CC=C5 |
Product Overview
RefChem:404741 (CAS 378770-91-3), with molecular formula C28H30N4O2S and molecular weight 486.21 g/mol. IUPAC: (5Z)-5-[[3-(4-butoxyphenyl)-1-phenylpyrazol-4-yl]methylidene]-2-piperidin-1-yl-1,3-thiazol-4-one.
Chemical Property Profile of RefChem:404741
Property Insights of RefChem:404741
The XLogP value of 6.1744 indicates that RefChem:404741 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.72 Ų, RefChem:404741 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:404741 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:404741?
The CAS number of RefChem:404741 is 378770-91-3.
What is the molecular formula of RefChem:404741?
The molecular formula of RefChem:404741 is C28H30N4O2S.
What is the molecular weight of RefChem:404741?
The molecular weight of RefChem:404741 is 486.21 g/mol.
Where can I buy RefChem:404741?
You can request a quote for RefChem:404741 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:404741?
Yes, KEHONG BIO provides custom synthesis services for RefChem:404741 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.