BAS 00284626
TL;DR: BAS 00284626 (CAS 92887-31-5) is a chemical compound with molecular formula C29H27FN4O2 and molecular weight 482.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-(4-fluorophenyl)methyl]-1,5-dimethyl-2-phenylpyrazol-3-one
Also Known As: BAS 00284626, 4-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-(4-fluorophenyl)methyl]-1,5-dimethyl-2-phenylpyrazol-3-one, 4,4'-((4-fluorophenyl)methylene)bis(1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one), 4,4'-[(4-fluorophenyl)methanediyl]bis(1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one), 4-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)(4-fluorophenyl)methyl]-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
| Molecular Formula | C29H27FN4O2 |
|---|---|
| Molecular Weight | 482.21 g/mol |
| LogP | 4.60154 |
| Topological Polar Surface Area | 53.86 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 482.2118 |
| Heavy Atoms | 36 |
| Complexity | 1553.5077 |
Chemical Identifiers
| CAS Number | 92887-31-5 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1C)C2=CC=CC=C2)C(C3=CC=C(C=C3)F)C4=C(N(N(C4=O)C5=CC=CC=C5)C)C |
Product Overview
BAS 00284626 (CAS 92887-31-5), with molecular formula C29H27FN4O2 and molecular weight 482.21 g/mol. IUPAC: 4-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-(4-fluorophenyl)methyl]-1,5-dimethyl-2-phenylpyrazol-3-one.
Chemical Property Profile of BAS 00284626
Property Insights of BAS 00284626
The XLogP value of 4.60154 indicates that BAS 00284626 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.86 Ų, BAS 00284626 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00284626 has 0 hydrogen bond donor(s) and 2 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 00284626?
The CAS number of BAS 00284626 is 92887-31-5.
What is the molecular formula of BAS 00284626?
The molecular formula of BAS 00284626 is C29H27FN4O2.
What is the molecular weight of BAS 00284626?
The molecular weight of BAS 00284626 is 482.21 g/mol.
Where can I buy BAS 00284626?
You can request a quote for BAS 00284626 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00284626?
Yes, KEHONG BIO provides custom synthesis services for BAS 00284626 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.