![(4E)-5-methyl-2-phenyl-4-[[4-(thietan-3-yloxy)phenyl]methylidene]pyrazol-3-one structure](/static/products/3598/359801-92-6.webp)
(4E)-5-methyl-2-phenyl-4-[[4-(thietan-3-yloxy)phenyl]methylidene]pyrazol-3-one
TL;DR: (4E)-5-methyl-2-phenyl-4-[[4-(thietan-3-yloxy)phenyl]methylidene]pyrazol-3-one (CAS 359801-92-6) is a chemical compound with molecular formula C20H18N2O2S and molecular weight 350.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-5-methyl-2-phenyl-4-[[4-(thietan-3-yloxy)phenyl]methylidene]pyrazol-3-one
Also Known As: BIM-0046936.P001, AE-641/14395032, (4E)-5-methyl-2-phenyl-4-[[4-(thietan-3-yloxy)phenyl]methylidene]pyrazol-3-one, 5-methyl-2-phenyl-4-[4-(3-thietanyloxy)benzylidene]-2,4-dihydro-3H-pyrazol-3-one
| Molecular Formula | C20H18N2O2S |
|---|---|
| Molecular Weight | 350.11 g/mol |
| LogP | 3.9869 |
| Topological Polar Surface Area | 41.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 350.1089 |
| Heavy Atoms | 25 |
| Complexity | 839.7597 |
Chemical Identifiers
| CAS Number | 359801-92-6 |
|---|---|
| SMILES | CC\1=NN(C(=O)/C1=C/C2=CC=C(C=C2)OC3CSC3)C4=CC=CC=C4 |
Product Overview
(4E)-5-methyl-2-phenyl-4-[[4-(thietan-3-yloxy)phenyl]methylidene]pyrazol-3-one (CAS 359801-92-6), with molecular formula C20H18N2O2S and molecular weight 350.11 g/mol. IUPAC: (4E)-5-methyl-2-phenyl-4-[[4-(thietan-3-yloxy)phenyl]methylidene]pyrazol-3-one.
Chemical Property Profile of (4E)-5-methyl-2-phenyl-4-[[4-(thietan-3-yloxy)phenyl]methylidene]pyrazol-3-one
Property Insights of (4E)-5-methyl-2-phenyl-4-[[4-(thietan-3-yloxy)phenyl]methylidene]pyrazol-3-one
The XLogP value of 3.9869 indicates that (4E)-5-methyl-2-phenyl-4-[[4-(thietan-3-yloxy)phenyl]methylidene]pyrazol-3-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, (4E)-5-methyl-2-phenyl-4-[[4-(thietan-3-yloxy)phenyl]methylidene]pyrazol-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4E)-5-methyl-2-phenyl-4-[[4-(thietan-3-yloxy)phenyl]methylidene]pyrazol-3-one has 0 hydrogen bond donor(s) and 4 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 (4E)-5-methyl-2-phenyl-4-[[4-(thietan-3-yloxy)phenyl]methylidene]pyrazol-3-one?
The CAS number of (4E)-5-methyl-2-phenyl-4-[[4-(thietan-3-yloxy)phenyl]methylidene]pyrazol-3-one is 359801-92-6.
What is the molecular formula of (4E)-5-methyl-2-phenyl-4-[[4-(thietan-3-yloxy)phenyl]methylidene]pyrazol-3-one?
The molecular formula of (4E)-5-methyl-2-phenyl-4-[[4-(thietan-3-yloxy)phenyl]methylidene]pyrazol-3-one is C20H18N2O2S.
What is the molecular weight of (4E)-5-methyl-2-phenyl-4-[[4-(thietan-3-yloxy)phenyl]methylidene]pyrazol-3-one?
The molecular weight of (4E)-5-methyl-2-phenyl-4-[[4-(thietan-3-yloxy)phenyl]methylidene]pyrazol-3-one is 350.11 g/mol.
Where can I buy (4E)-5-methyl-2-phenyl-4-[[4-(thietan-3-yloxy)phenyl]methylidene]pyrazol-3-one?
You can request a quote for (4E)-5-methyl-2-phenyl-4-[[4-(thietan-3-yloxy)phenyl]methylidene]pyrazol-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4E)-5-methyl-2-phenyl-4-[[4-(thietan-3-yloxy)phenyl]methylidene]pyrazol-3-one?
Yes, KEHONG BIO provides custom synthesis services for (4E)-5-methyl-2-phenyl-4-[[4-(thietan-3-yloxy)phenyl]methylidene]pyrazol-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.