![(4E)-4-({1-[3-(benzylamino)-2-hydroxypropyl]-1H-indol-3-yl}methylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one structure](/static/products/892/892620-32-5.png)
(4E)-4-({1-[3-(benzylamino)-2-hydroxypropyl]-1H-indol-3-yl}methylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
TL;DR: (4E)-4-({1-[3-(benzylamino)-2-hydroxypropyl]-1H-indol-3-yl}methylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one (CAS 892620-32-5) is a chemical compound with molecular formula C29H28N4O2 and molecular weight 464.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-4-[[1-[3-(benzylamino)-2-hydroxypropyl]indol-3-yl]methylidene]-5-methyl-2-phenylpyrazol-3-one
Also Known As: (4E)-4-({1-[3-(benzylamino)-2-hydroxypropyl]-1H-indol-3-yl}methylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one, (4E)-4-[[1-[3-(benzylamino)-2-hydroxypropyl]indol-3-yl]methylidene]-5-methyl-2-phenylpyrazol-3-one, (E)-4-((1-(3-(benzylamino)-2-hydroxypropyl)-1H-indol-3-yl)methylene)-3-methyl-1-phenyl-1H-pyrazol-5(4H)-one, 4-[[1-[3-(benzylamino)-2-hydroxy-propyl]indol-3-yl]methylidene]-5-methyl-2-phenyl-pyrazol-3-one
| Molecular Formula | C29H28N4O2 |
|---|---|
| Molecular Weight | 464.22 g/mol |
| LogP | 4.5981 |
| Topological Polar Surface Area | 69.86 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 464.22122 |
| Heavy Atoms | 35 |
| Complexity | 1390.2463 |
Chemical Identifiers
| CAS Number | 892620-32-5 |
|---|---|
| SMILES | CC\1=NN(C(=O)/C1=C/C2=CN(C3=CC=CC=C32)CC(CNCC4=CC=CC=C4)O)C5=CC=CC=C5 |
Product Overview
(4E)-4-({1-[3-(benzylamino)-2-hydroxypropyl]-1H-indol-3-yl}methylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one (CAS 892620-32-5), with molecular formula C29H28N4O2 and molecular weight 464.22 g/mol. IUPAC: (4E)-4-[[1-[3-(benzylamino)-2-hydroxypropyl]indol-3-yl]methylidene]-5-methyl-2-phenylpyrazol-3-one.
Chemical Property Profile of (4E)-4-({1-[3-(benzylamino)-2-hydroxypropyl]-1H-indol-3-yl}methylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Property Insights of (4E)-4-({1-[3-(benzylamino)-2-hydroxypropyl]-1H-indol-3-yl}methylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
The XLogP value of 4.5981 indicates that (4E)-4-({1-[3-(benzylamino)-2-hydroxypropyl]-1H-indol-3-yl}methylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.86 Ų falls within the moderate polarity range, balancing permeability and solubility for (4E)-4-({1-[3-(benzylamino)-2-hydroxypropyl]-1H-indol-3-yl}methylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one. Following Lipinski's Rule of Five, (4E)-4-({1-[3-(benzylamino)-2-hydroxypropyl]-1H-indol-3-yl}methylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one has 2 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)-4-({1-[3-(benzylamino)-2-hydroxypropyl]-1H-indol-3-yl}methylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one?
The CAS number of (4E)-4-({1-[3-(benzylamino)-2-hydroxypropyl]-1H-indol-3-yl}methylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one is 892620-32-5.
What is the molecular formula of (4E)-4-({1-[3-(benzylamino)-2-hydroxypropyl]-1H-indol-3-yl}methylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one?
The molecular formula of (4E)-4-({1-[3-(benzylamino)-2-hydroxypropyl]-1H-indol-3-yl}methylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one is C29H28N4O2.
What is the molecular weight of (4E)-4-({1-[3-(benzylamino)-2-hydroxypropyl]-1H-indol-3-yl}methylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one?
The molecular weight of (4E)-4-({1-[3-(benzylamino)-2-hydroxypropyl]-1H-indol-3-yl}methylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one is 464.22 g/mol.
Where can I buy (4E)-4-({1-[3-(benzylamino)-2-hydroxypropyl]-1H-indol-3-yl}methylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one?
You can request a quote for (4E)-4-({1-[3-(benzylamino)-2-hydroxypropyl]-1H-indol-3-yl}methylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-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)-4-({1-[3-(benzylamino)-2-hydroxypropyl]-1H-indol-3-yl}methylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one?
Yes, KEHONG BIO provides custom synthesis services for (4E)-4-({1-[3-(benzylamino)-2-hydroxypropyl]-1H-indol-3-yl}methylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.