Bionet1_000281
TL;DR: Bionet1_000281 (CAS 338750-94-0) is a chemical compound with molecular formula C20H19N3O4 and molecular weight 365.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[(5-ethoxy-3-oxo-2-phenyl-1H-pyrazol-4-yl)methylideneamino]benzoate
Also Known As: Bionet1_000281, DivK1c_002297, CDS1_001257, 5C-061, methyl 4-{[(3-ethoxy-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-yliden)methyl]amino}benzenecarboxylate
| Molecular Formula | C20H19N3O4 |
|---|---|
| Molecular Weight | 365.14 g/mol |
| LogP | 3.1015 |
| Topological Polar Surface Area | 85.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 365.13754 |
| Heavy Atoms | 27 |
| Complexity | 1001.9561 |
Chemical Identifiers
| CAS Number | 338750-94-0 |
|---|---|
| SMILES | CCOC1=C(C(=O)N(N1)C2=CC=CC=C2)C=NC3=CC=C(C=C3)C(=O)OC |
Product Overview
Bionet1_000281 (CAS 338750-94-0), with molecular formula C20H19N3O4 and molecular weight 365.14 g/mol. IUPAC: methyl 4-[(5-ethoxy-3-oxo-2-phenyl-1H-pyrazol-4-yl)methylideneamino]benzoate.
Chemical Property Profile of Bionet1_000281
Property Insights of Bionet1_000281
The XLogP value of 3.1015 indicates that Bionet1_000281 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.68 Ų falls within the moderate polarity range, balancing permeability and solubility for Bionet1_000281. Following Lipinski's Rule of Five, Bionet1_000281 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 Bionet1_000281?
The CAS number of Bionet1_000281 is 338750-94-0.
What is the molecular formula of Bionet1_000281?
The molecular formula of Bionet1_000281 is C20H19N3O4.
What is the molecular weight of Bionet1_000281?
The molecular weight of Bionet1_000281 is 365.14 g/mol.
Where can I buy Bionet1_000281?
You can request a quote for Bionet1_000281 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet1_000281?
Yes, KEHONG BIO provides custom synthesis services for Bionet1_000281 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.