4,4'-((4-bromophenyl)methylene)bis(1-hexyl-3-methyl-1H-pyrazol-5-ol)
TL;DR: 4,4'-((4-bromophenyl)methylene)bis(1-hexyl-3-methyl-1H-pyrazol-5-ol) (CAS 153231-84-6) is a chemical compound with molecular formula C27H39BrN4O2 and molecular weight 530.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(4-bromophenyl)-(2-hexyl-5-methyl-3-oxo-1H-pyrazol-4-yl)methyl]-2-hexyl-5-methyl-1H-pyrazol-3-one
Also Known As: 4,4'-((4-bromophenyl)methylene)bis(1-hexyl-3-methyl-1H-pyrazol-5-ol), 4,4'-[(4-bromophenyl)methanediyl]bis(1-hexyl-3-methyl-1H-pyrazol-5-ol), 4-[(4-bromophenyl)-(2-hexyl-5-methyl-3-oxo-1H-pyrazol-4-yl)methyl]-2-hexyl-5-methyl-1H-pyrazol-3-one
| Molecular Formula | C27H39BrN4O2 |
|---|---|
| Molecular Weight | 530.23 g/mol |
| LogP | 6.38634 |
| Topological Polar Surface Area | 75.58 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 13 |
| Exact Mass | 530.22565 |
| Heavy Atoms | 34 |
| Complexity | 1096.6896 |
Chemical Identifiers
| CAS Number | 153231-84-6 |
|---|---|
| SMILES | CCCCCCN1C(=O)C(=C(N1)C)C(C2=CC=C(C=C2)Br)C3=C(NN(C3=O)CCCCCC)C |
Product Overview
4,4'-((4-bromophenyl)methylene)bis(1-hexyl-3-methyl-1H-pyrazol-5-ol) (CAS 153231-84-6), with molecular formula C27H39BrN4O2 and molecular weight 530.23 g/mol. IUPAC: 4-[(4-bromophenyl)-(2-hexyl-5-methyl-3-oxo-1H-pyrazol-4-yl)methyl]-2-hexyl-5-methyl-1H-pyrazol-3-one.
Chemical Property Profile of 4,4'-((4-bromophenyl)methylene)bis(1-hexyl-3-methyl-1H-pyrazol-5-ol)
Property Insights of 4,4'-((4-bromophenyl)methylene)bis(1-hexyl-3-methyl-1H-pyrazol-5-ol)
The XLogP value of 6.38634 indicates that 4,4'-((4-bromophenyl)methylene)bis(1-hexyl-3-methyl-1H-pyrazol-5-ol) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.58 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,4'-((4-bromophenyl)methylene)bis(1-hexyl-3-methyl-1H-pyrazol-5-ol). Following Lipinski's Rule of Five, 4,4'-((4-bromophenyl)methylene)bis(1-hexyl-3-methyl-1H-pyrazol-5-ol) has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4,4'-((4-bromophenyl)methylene)bis(1-hexyl-3-methyl-1H-pyrazol-5-ol)?
The CAS number of 4,4'-((4-bromophenyl)methylene)bis(1-hexyl-3-methyl-1H-pyrazol-5-ol) is 153231-84-6.
What is the molecular formula of 4,4'-((4-bromophenyl)methylene)bis(1-hexyl-3-methyl-1H-pyrazol-5-ol)?
The molecular formula of 4,4'-((4-bromophenyl)methylene)bis(1-hexyl-3-methyl-1H-pyrazol-5-ol) is C27H39BrN4O2.
What is the molecular weight of 4,4'-((4-bromophenyl)methylene)bis(1-hexyl-3-methyl-1H-pyrazol-5-ol)?
The molecular weight of 4,4'-((4-bromophenyl)methylene)bis(1-hexyl-3-methyl-1H-pyrazol-5-ol) is 530.23 g/mol.
Where can I buy 4,4'-((4-bromophenyl)methylene)bis(1-hexyl-3-methyl-1H-pyrazol-5-ol)?
You can request a quote for 4,4'-((4-bromophenyl)methylene)bis(1-hexyl-3-methyl-1H-pyrazol-5-ol) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,4'-((4-bromophenyl)methylene)bis(1-hexyl-3-methyl-1H-pyrazol-5-ol)?
Yes, KEHONG BIO provides custom synthesis services for 4,4'-((4-bromophenyl)methylene)bis(1-hexyl-3-methyl-1H-pyrazol-5-ol) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.