BAS 01364842
TL;DR: BAS 01364842 (CAS 405899-49-2) is a chemical compound with molecular formula C29H28N4O4 and molecular weight 496.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(3-ethoxy-4-hydroxyphenyl)-(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)methyl]-5-methyl-2-phenyl-1H-pyrazol-3-one
Also Known As: BAS 01364842, AJ-145/37124003, 4,4'-[(3-ethoxy-4-hydroxyphenyl)methanediyl]bis(3-methyl-1-phenyl-1H-pyrazol-5-ol), 4-[(3-ETHOXY-4-HYDROXYPHENYL)(5-HYDROXY-3-METHYL-1-PHENYL-1H-PYRAZOL-4-YL)METHYL]-3-METHYL-1-PHENYL-1H-PYRAZOL-5-OL, 4,4'-((3-ethoxy-4-hydroxyphenyl)methylene)bis(3-methyl-1-phenyl-1H-pyrazol-5-ol)
| Molecular Formula | C29H28N4O4 |
|---|---|
| Molecular Weight | 496.21 g/mol |
| LogP | 4.54594 |
| Topological Polar Surface Area | 105.04 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 496.21106 |
| Heavy Atoms | 37 |
| Complexity | 1562.305 |
Chemical Identifiers
| CAS Number | 405899-49-2 |
|---|---|
| SMILES | CCOC1=C(C=CC(=C1)C(C2=C(NN(C2=O)C3=CC=CC=C3)C)C4=C(NN(C4=O)C5=CC=CC=C5)C)O |
Product Overview
BAS 01364842 (CAS 405899-49-2), with molecular formula C29H28N4O4 and molecular weight 496.21 g/mol. IUPAC: 4-[(3-ethoxy-4-hydroxyphenyl)-(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)methyl]-5-methyl-2-phenyl-1H-pyrazol-3-one.
Chemical Property Profile of BAS 01364842
Property Insights of BAS 01364842
The XLogP value of 4.54594 indicates that BAS 01364842 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 105.04 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01364842. Following Lipinski's Rule of Five, BAS 01364842 has 3 hydrogen bond donor(s) and 4 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 01364842?
The CAS number of BAS 01364842 is 405899-49-2.
What is the molecular formula of BAS 01364842?
The molecular formula of BAS 01364842 is C29H28N4O4.
What is the molecular weight of BAS 01364842?
The molecular weight of BAS 01364842 is 496.21 g/mol.
Where can I buy BAS 01364842?
You can request a quote for BAS 01364842 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01364842?
Yes, KEHONG BIO provides custom synthesis services for BAS 01364842 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.