BAS 00294586
TL;DR: BAS 00294586 (CAS 341983-36-6) is a chemical compound with molecular formula C21H16N4O6 and molecular weight 420.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-methoxy-4-[(E)-(pyridine-3-carbonylhydrazinylidene)methyl]phenyl] 4-nitrobenzoate
Also Known As: BAS 00294586, (E)-2-methoxy-4-((2-nicotinoylhydrazono)methyl)phenyl 4-nitrobenzoate, [2-methoxy-4-[(E)-(pyridine-3-carbonylhydrazinylidene)methyl]phenyl] 4-nitrobenzoate, 2-methoxy-4-{(E)-[2-(pyridin-3-ylcarbonyl)hydrazinylidene]methyl}phenyl 4-nitrobenzoate, 4-Nitro-benzoic acid 2-methoxy-4-[(pyridine-3-carbonyl)-hydrazonomethyl]-phenyl
| Molecular Formula | C21H16N4O6 |
|---|---|
| Molecular Weight | 420.11 g/mol |
| LogP | 2.9815 |
| Topological Polar Surface Area | 133.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 420.107 |
| Heavy Atoms | 31 |
| Complexity | 1130.3667 |
Chemical Identifiers
| CAS Number | 341983-36-6 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)/C=N/NC(=O)C2=CN=CC=C2)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-] |
Product Overview
BAS 00294586 (CAS 341983-36-6), with molecular formula C21H16N4O6 and molecular weight 420.11 g/mol. IUPAC: [2-methoxy-4-[(E)-(pyridine-3-carbonylhydrazinylidene)methyl]phenyl] 4-nitrobenzoate.
Chemical Property Profile of BAS 00294586
Property Insights of BAS 00294586
The XLogP value of 2.9815 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00294586. The TPSA of 133.02 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00294586. Following Lipinski's Rule of Five, BAS 00294586 has 1 hydrogen bond donor(s) and 8 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 BAS 00294586?
The CAS number of BAS 00294586 is 341983-36-6.
What is the molecular formula of BAS 00294586?
The molecular formula of BAS 00294586 is C21H16N4O6.
What is the molecular weight of BAS 00294586?
The molecular weight of BAS 00294586 is 420.11 g/mol.
Where can I buy BAS 00294586?
You can request a quote for BAS 00294586 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00294586?
Yes, KEHONG BIO provides custom synthesis services for BAS 00294586 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.