ChemDiv1_019171
TL;DR: ChemDiv1_019171 (CAS 945671-25-0) is a chemical compound with molecular formula C19H19N3O2 and molecular weight 321.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(2-methoxyphenyl)methylideneamino]-1,5-dimethyl-2-phenylpyrazol-3-one
Also Known As: ChemDiv1_019171, UPCMLD0ENAT5753091:001, BAS 00348002, J3.316.731H, 4-{[(E)-(2-methoxyphenyl)methylidene]amino}-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
| Molecular Formula | C19H19N3O2 |
|---|---|
| Molecular Weight | 321.15 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 45.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 321.14774 |
| Heavy Atoms | 24 |
| Complexity | 523.0 |
Chemical Identifiers
| CAS Number | 945671-25-0 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N=CC3=CC=CC=C3OC |
| InChIKey | KZYVSBDKGIWJCC-UHFFFAOYSA-N |
Product Overview
ChemDiv1_019171 (CAS 945671-25-0), with molecular formula C19H19N3O2 and molecular weight 321.15 g/mol. IUPAC: 4-[(2-methoxyphenyl)methylideneamino]-1,5-dimethyl-2-phenylpyrazol-3-one.
Chemical Property Profile of ChemDiv1_019171
Property Insights of ChemDiv1_019171
The XLogP value of 3.5 indicates that ChemDiv1_019171 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.1 Ų, ChemDiv1_019171 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv1_019171 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 ChemDiv1_019171?
The CAS number of ChemDiv1_019171 is 945671-25-0.
What is the molecular formula of ChemDiv1_019171?
The molecular formula of ChemDiv1_019171 is C19H19N3O2.
What is the molecular weight of ChemDiv1_019171?
The molecular weight of ChemDiv1_019171 is 321.15 g/mol.
Where can I buy ChemDiv1_019171?
You can request a quote for ChemDiv1_019171 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_019171?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_019171 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.