BAS 01859081
TL;DR: BAS 01859081 (CAS 1285540-45-5) is a chemical compound with molecular formula C17H12FN5O3 and molecular weight 353.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-fluorophenyl)-N-[(E)-(4-nitrophenyl)methylideneamino]-1H-pyrazole-5-carboxamide
Also Known As: BAS 01859081, 3-(4-fluorophenyl)-N'-[(E)-(4-nitrophenyl)methylidene]-1H-pyrazole-5-carbohydrazide, (E)-3-(4-fluorophenyl)-N'-(4-nitrobenzylidene)-1H-pyrazole-5-carbohydrazide, 3-(4-FLUOROPHENYL)-N'-(4-NITROBENZYLIDENE)-1H-PYRAZOLE-5-CARBOHYDRAZIDE, 3-(4-fluorophenyl)-N-[(E)-(4-nitrophenyl)methylideneamino]-1H-pyrazole-5-carboxamide
| Molecular Formula | C17H12FN5O3 |
|---|---|
| Molecular Weight | 353.09 g/mol |
| LogP | 2.8879 |
| Topological Polar Surface Area | 113.28 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 353.0924 |
| Heavy Atoms | 26 |
| Complexity | 964.82324 |
Chemical Identifiers
| CAS Number | 1285540-45-5 |
|---|---|
| SMILES | C1=CC(=CC=C1/C=N/NC(=O)C2=CC(=NN2)C3=CC=C(C=C3)F)[N+](=O)[O-] |
Product Overview
BAS 01859081 (CAS 1285540-45-5), with molecular formula C17H12FN5O3 and molecular weight 353.09 g/mol. IUPAC: 3-(4-fluorophenyl)-N-[(E)-(4-nitrophenyl)methylideneamino]-1H-pyrazole-5-carboxamide.
Chemical Property Profile of BAS 01859081
Property Insights of BAS 01859081
The XLogP value of 2.8879 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 01859081. The TPSA of 113.28 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01859081. Following Lipinski's Rule of Five, BAS 01859081 has 2 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 BAS 01859081?
The CAS number of BAS 01859081 is 1285540-45-5.
What is the molecular formula of BAS 01859081?
The molecular formula of BAS 01859081 is C17H12FN5O3.
What is the molecular weight of BAS 01859081?
The molecular weight of BAS 01859081 is 353.09 g/mol.
Where can I buy BAS 01859081?
You can request a quote for BAS 01859081 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01859081?
Yes, KEHONG BIO provides custom synthesis services for BAS 01859081 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.