4-((3,5-dibromo-2-hydroxybenzyl)amino)-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one
TL;DR: 4-((3,5-dibromo-2-hydroxybenzyl)amino)-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one (CAS 371234-27-4) is a chemical compound with molecular formula C18H17Br2N3O2 and molecular weight 464.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(3,5-dibromo-2-hydroxyphenyl)methylamino]-1,5-dimethyl-2-phenylpyrazol-3-one
Also Known As: 4-((3,5-dibromo-2-hydroxybenzyl)amino)-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one, 4-[(3,5-dibromo-2-hydroxy-phenyl)methylamino]-1,5-dimethyl-2-phenyl-pyrazol-3-one, 4-[(3,5-dibromo-2-hydroxyphenyl)methylamino]-1,5-dimethyl-2-phenylpyrazol-3-one, 4-[(3,5-dibromo-2-hydroxybenzyl)amino]-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
| Molecular Formula | C18H17Br2N3O2 |
|---|---|
| Molecular Weight | 464.97 g/mol |
| LogP | 4.32712 |
| Topological Polar Surface Area | 59.19 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 464.96875 |
| Heavy Atoms | 25 |
| Complexity | 978.2216 |
Chemical Identifiers
| CAS Number | 371234-27-4 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NCC3=C(C(=CC(=C3)Br)Br)O |
Product Overview
4-((3,5-dibromo-2-hydroxybenzyl)amino)-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one (CAS 371234-27-4), with molecular formula C18H17Br2N3O2 and molecular weight 464.97 g/mol. IUPAC: 4-[(3,5-dibromo-2-hydroxyphenyl)methylamino]-1,5-dimethyl-2-phenylpyrazol-3-one.
Chemical Property Profile of 4-((3,5-dibromo-2-hydroxybenzyl)amino)-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one
Property Insights of 4-((3,5-dibromo-2-hydroxybenzyl)amino)-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one
The XLogP value of 4.32712 indicates that 4-((3,5-dibromo-2-hydroxybenzyl)amino)-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.19 Ų, 4-((3,5-dibromo-2-hydroxybenzyl)amino)-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-((3,5-dibromo-2-hydroxybenzyl)amino)-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one has 2 hydrogen bond donor(s) and 3 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 4-((3,5-dibromo-2-hydroxybenzyl)amino)-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one?
The CAS number of 4-((3,5-dibromo-2-hydroxybenzyl)amino)-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one is 371234-27-4.
What is the molecular formula of 4-((3,5-dibromo-2-hydroxybenzyl)amino)-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one?
The molecular formula of 4-((3,5-dibromo-2-hydroxybenzyl)amino)-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one is C18H17Br2N3O2.
What is the molecular weight of 4-((3,5-dibromo-2-hydroxybenzyl)amino)-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one?
The molecular weight of 4-((3,5-dibromo-2-hydroxybenzyl)amino)-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one is 464.97 g/mol.
Where can I buy 4-((3,5-dibromo-2-hydroxybenzyl)amino)-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one?
You can request a quote for 4-((3,5-dibromo-2-hydroxybenzyl)amino)-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-((3,5-dibromo-2-hydroxybenzyl)amino)-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one?
Yes, KEHONG BIO provides custom synthesis services for 4-((3,5-dibromo-2-hydroxybenzyl)amino)-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.