AB00096290-01
TL;DR: AB00096290-01 (CAS 371950-90-2) is a chemical compound with molecular formula C20H20N4O4 and molecular weight 380.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(3-methoxypropyliminomethyl)-2-(4-nitrophenyl)-5-phenyl-1H-pyrazol-3-one
Also Known As: AB00096290-01, (4Z)-4-[(3-methoxypropylamino)methylidene]-2-(4-nitrophenyl)-5-phenylpyrazol-3-one, (E)-4-(((3-methoxypropyl)imino)methyl)-2-(4-nitrophenyl)-5-phenyl-1H-pyrazol-3(2H)-one, 4-[(3-methoxypropylamino)methylidene]-2-(4-nitrophenyl)-5-phenylpyrazol-3-one, 4-{(E)-[(3-methoxypropyl)imino]methyl}-2-(4-nitrophenyl)-5-phenyl-1,2-dihydro-3H-pyrazol-3-one
| Molecular Formula | C20H20N4O4 |
|---|---|
| Molecular Weight | 380.15 g/mol |
| LogP | 3.1962 |
| Topological Polar Surface Area | 102.52 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 380.14847 |
| Heavy Atoms | 28 |
| Complexity | 1020.6093 |
Chemical Identifiers
| CAS Number | 371950-90-2 |
|---|---|
| SMILES | COCCCN=CC1=C(NN(C1=O)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3 |
Product Overview
AB00096290-01 (CAS 371950-90-2), with molecular formula C20H20N4O4 and molecular weight 380.15 g/mol. IUPAC: 4-(3-methoxypropyliminomethyl)-2-(4-nitrophenyl)-5-phenyl-1H-pyrazol-3-one.
Chemical Property Profile of AB00096290-01
Property Insights of AB00096290-01
The XLogP value of 3.1962 indicates that AB00096290-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.52 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00096290-01. Following Lipinski's Rule of Five, AB00096290-01 has 1 hydrogen bond donor(s) and 5 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 AB00096290-01?
The CAS number of AB00096290-01 is 371950-90-2.
What is the molecular formula of AB00096290-01?
The molecular formula of AB00096290-01 is C20H20N4O4.
What is the molecular weight of AB00096290-01?
The molecular weight of AB00096290-01 is 380.15 g/mol.
Where can I buy AB00096290-01?
You can request a quote for AB00096290-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00096290-01?
Yes, KEHONG BIO provides custom synthesis services for AB00096290-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.