![(4E)-4-[[1-(dimethylaminomethyl)indol-3-yl]methylidene]-5-methyl-2-phenylpyrazol-3-one structure](/static/products/836/836638-71-2.png)
(4E)-4-[[1-(dimethylaminomethyl)indol-3-yl]methylidene]-5-methyl-2-phenylpyrazol-3-one
TL;DR: (4E)-4-[[1-(dimethylaminomethyl)indol-3-yl]methylidene]-5-methyl-2-phenylpyrazol-3-one (CAS 836638-71-2) is a chemical compound with molecular formula C22H22N4O and molecular weight 358.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-4-[[1-[(dimethylamino)methyl]indol-3-yl]methylidene]-5-methyl-2-phenylpyrazol-3-one
Also Known As: (4E)-4-[[1-(dimethylaminomethyl)indol-3-yl]methylidene]-5-methyl-2-phenylpyrazol-3-one, 4-[[1-(dimethylaminomethyl)indol-3-yl]methylidene]-5-methyl-2-phenyl-pyrazol-3-one, (4E)-4-({1-[(dimethylamino)methyl]-1H-indol-3-yl}methylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one, (E)-4-((1-((dimethylamino)methyl)-1H-indol-3-yl)methylene)-3-methyl-1-phenyl-1H-pyrazol-5(4H)-one
| Molecular Formula | C22H22N4O |
|---|---|
| Molecular Weight | 358.18 g/mol |
| LogP | 3.9665 |
| Topological Polar Surface Area | 40.84 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 358.17935 |
| Heavy Atoms | 27 |
| Complexity | 1060.3661 |
Chemical Identifiers
| CAS Number | 836638-71-2 |
|---|---|
| SMILES | CC\1=NN(C(=O)/C1=C/C2=CN(C3=CC=CC=C32)CN(C)C)C4=CC=CC=C4 |
Product Overview
(4E)-4-[[1-(dimethylaminomethyl)indol-3-yl]methylidene]-5-methyl-2-phenylpyrazol-3-one (CAS 836638-71-2), with molecular formula C22H22N4O and molecular weight 358.18 g/mol. IUPAC: (4E)-4-[[1-[(dimethylamino)methyl]indol-3-yl]methylidene]-5-methyl-2-phenylpyrazol-3-one.
Chemical Property Profile of (4E)-4-[[1-(dimethylaminomethyl)indol-3-yl]methylidene]-5-methyl-2-phenylpyrazol-3-one
Property Insights of (4E)-4-[[1-(dimethylaminomethyl)indol-3-yl]methylidene]-5-methyl-2-phenylpyrazol-3-one
The XLogP value of 3.9665 indicates that (4E)-4-[[1-(dimethylaminomethyl)indol-3-yl]methylidene]-5-methyl-2-phenylpyrazol-3-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.84 Ų, (4E)-4-[[1-(dimethylaminomethyl)indol-3-yl]methylidene]-5-methyl-2-phenylpyrazol-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4E)-4-[[1-(dimethylaminomethyl)indol-3-yl]methylidene]-5-methyl-2-phenylpyrazol-3-one has 0 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 (4E)-4-[[1-(dimethylaminomethyl)indol-3-yl]methylidene]-5-methyl-2-phenylpyrazol-3-one?
The CAS number of (4E)-4-[[1-(dimethylaminomethyl)indol-3-yl]methylidene]-5-methyl-2-phenylpyrazol-3-one is 836638-71-2.
What is the molecular formula of (4E)-4-[[1-(dimethylaminomethyl)indol-3-yl]methylidene]-5-methyl-2-phenylpyrazol-3-one?
The molecular formula of (4E)-4-[[1-(dimethylaminomethyl)indol-3-yl]methylidene]-5-methyl-2-phenylpyrazol-3-one is C22H22N4O.
What is the molecular weight of (4E)-4-[[1-(dimethylaminomethyl)indol-3-yl]methylidene]-5-methyl-2-phenylpyrazol-3-one?
The molecular weight of (4E)-4-[[1-(dimethylaminomethyl)indol-3-yl]methylidene]-5-methyl-2-phenylpyrazol-3-one is 358.18 g/mol.
Where can I buy (4E)-4-[[1-(dimethylaminomethyl)indol-3-yl]methylidene]-5-methyl-2-phenylpyrazol-3-one?
You can request a quote for (4E)-4-[[1-(dimethylaminomethyl)indol-3-yl]methylidene]-5-methyl-2-phenylpyrazol-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)-4-[[1-(dimethylaminomethyl)indol-3-yl]methylidene]-5-methyl-2-phenylpyrazol-3-one?
Yes, KEHONG BIO provides custom synthesis services for (4E)-4-[[1-(dimethylaminomethyl)indol-3-yl]methylidene]-5-methyl-2-phenylpyrazol-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.