RefChem:296133
TL;DR: RefChem:296133 (CAS 42055-79-8) is a chemical compound with molecular formula C19H21F3N4O2 and molecular weight 394.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[6-(azepan-1-yl)-2-[3-(trifluoromethyl)phenyl]pyrimidin-4-yl]-N-hydroxyacetamide
Also Known As: 4-Pyrimidineacetamide, 6-(hexahydro-1H-azepin-1-yl)-N-hydroxy-2-(3-(trifluoromethyl)phenyl)-, 6-(Hexahydro-1H-azepin-1-yl)-N-hydroxy-2-(3-(trifluoromethyl)phenyl)-4-pyrimidineacetamide, 2-(6-(Azepan-1-yl)-2-(3-(trifluoromethyl)phenyl)pyrimidin-4-yl)-N-hydroxyacetamide, 4-Pyrimidineacetohydroxamic acid, 6-(hexahydro-1H-azepin-1-yl)-2-(3-(trifluoromethyl)phenyl)-, 2-[6-(azepan-1-yl)-2-[3-(trifluoromethyl)phenyl]pyrimidin-4-yl]-N-hydroxyacetamide
| Molecular Formula | C19H21F3N4O2 |
|---|---|
| Molecular Weight | 394.16 g/mol |
| LogP | 3.5907 |
| Topological Polar Surface Area | 78.35 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 394.16165 |
| Heavy Atoms | 28 |
| Complexity | 834.1687 |
Chemical Identifiers
| CAS Number | 42055-79-8 |
|---|---|
| SMILES | C1CCCN(CC1)C2=NC(=NC(=C2)CC(=O)NO)C3=CC(=CC=C3)C(F)(F)F |
Product Overview
RefChem:296133 (CAS 42055-79-8), with molecular formula C19H21F3N4O2 and molecular weight 394.16 g/mol. IUPAC: 2-[6-(azepan-1-yl)-2-[3-(trifluoromethyl)phenyl]pyrimidin-4-yl]-N-hydroxyacetamide.
Chemical Property Profile of RefChem:296133
Property Insights of RefChem:296133
The XLogP value of 3.5907 indicates that RefChem:296133 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.35 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:296133. Following Lipinski's Rule of Five, RefChem:296133 has 2 hydrogen bond donor(s) and 5 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 RefChem:296133?
The CAS number of RefChem:296133 is 42055-79-8.
What is the molecular formula of RefChem:296133?
The molecular formula of RefChem:296133 is C19H21F3N4O2.
What is the molecular weight of RefChem:296133?
The molecular weight of RefChem:296133 is 394.16 g/mol.
Where can I buy RefChem:296133?
You can request a quote for RefChem:296133 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:296133?
Yes, KEHONG BIO provides custom synthesis services for RefChem:296133 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.