BAS 00488809
TL;DR: BAS 00488809 (CAS 314763-48-9) is a chemical compound with molecular formula C22H15N5O5 and molecular weight 429.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-(4-nitrophenyl)-3-oxo-2-phenyl-1H-pyrazol-4-yl]diazenyl]benzoic acid
Also Known As: BAS 00488809, 2-{2-[3-(4-nitrophenyl)-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene]hydrazino}benzoic acid, 2-[[5-(4-nitrophenyl)-3-oxo-2-phenyl-1H-pyrazol-4-yl]diazenyl]benzoic acid, 2-(2-(3-(4-Nitrophenyl)-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene)hydrazinyl)benzoic acid, 2-[(2E)-2-[3-(4-nitrophenyl)-5-oxo-1-phenylpyrazol-4-ylidene]hydrazinyl]benzoic acid
| Molecular Formula | C22H15N5O5 |
|---|---|
| Molecular Weight | 429.11 g/mol |
| LogP | 4.8544 |
| Topological Polar Surface Area | 142.95 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 429.10733 |
| Heavy Atoms | 32 |
| Complexity | 1388.4912 |
Chemical Identifiers
| CAS Number | 314763-48-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C(=O)C(=C(N2)C3=CC=C(C=C3)[N+](=O)[O-])N=NC4=CC=CC=C4C(=O)O |
Product Overview
BAS 00488809 (CAS 314763-48-9), with molecular formula C22H15N5O5 and molecular weight 429.11 g/mol. IUPAC: 2-[[5-(4-nitrophenyl)-3-oxo-2-phenyl-1H-pyrazol-4-yl]diazenyl]benzoic acid.
Chemical Property Profile of BAS 00488809
Property Insights of BAS 00488809
The XLogP value of 4.8544 indicates that BAS 00488809 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 142.95 Ų indicates high polarity, suggesting BAS 00488809 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, BAS 00488809 has 2 hydrogen bond donor(s) and 6 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 00488809?
The CAS number of BAS 00488809 is 314763-48-9.
What is the molecular formula of BAS 00488809?
The molecular formula of BAS 00488809 is C22H15N5O5.
What is the molecular weight of BAS 00488809?
The molecular weight of BAS 00488809 is 429.11 g/mol.
Where can I buy BAS 00488809?
You can request a quote for BAS 00488809 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00488809?
Yes, KEHONG BIO provides custom synthesis services for BAS 00488809 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.