BAS 02998925
TL;DR: BAS 02998925 (CAS 314291-88-8) 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.
3-[[5-(4-nitrophenyl)-3-oxo-2-phenyl-1H-pyrazol-4-yl]diazenyl]benzoic acid
Also Known As: BAS 02998925, 3-{2-[3-(4-nitrophenyl)-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene]hydrazino}benzoic acid, 3-[[5-(4-nitrophenyl)-3-oxo-2-phenyl-1H-pyrazol-4-yl]diazenyl]benzoic acid, 3-[(2E)-2-[3-(4-nitrophenyl)-5-oxo-1-phenylpyrazol-4-ylidene]hydrazinyl]benzoic acid, 3-[(2Z)-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 | 314291-88-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C(=O)C(=C(N2)C3=CC=C(C=C3)[N+](=O)[O-])N=NC4=CC=CC(=C4)C(=O)O |
Product Overview
BAS 02998925 (CAS 314291-88-8), with molecular formula C22H15N5O5 and molecular weight 429.11 g/mol. IUPAC: 3-[[5-(4-nitrophenyl)-3-oxo-2-phenyl-1H-pyrazol-4-yl]diazenyl]benzoic acid.
Chemical Property Profile of BAS 02998925
Property Insights of BAS 02998925
The XLogP value of 4.8544 indicates that BAS 02998925 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 142.95 Ų indicates high polarity, suggesting BAS 02998925 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, BAS 02998925 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 02998925?
The CAS number of BAS 02998925 is 314291-88-8.
What is the molecular formula of BAS 02998925?
The molecular formula of BAS 02998925 is C22H15N5O5.
What is the molecular weight of BAS 02998925?
The molecular weight of BAS 02998925 is 429.11 g/mol.
Where can I buy BAS 02998925?
You can request a quote for BAS 02998925 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02998925?
Yes, KEHONG BIO provides custom synthesis services for BAS 02998925 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.