5-Acetyl-4-hydroxy-6-(3-methylphenyl)-4-(trifluoromethyl)-1,3-diazinan-2-one
TL;DR: 5-Acetyl-4-hydroxy-6-(3-methylphenyl)-4-(trifluoromethyl)-1,3-diazinan-2-one (CAS 1005286-99-6) is a chemical compound with molecular formula C14H15F3N2O3 and molecular weight 316.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-acetyl-4-hydroxy-6-(3-methylphenyl)-4-(trifluoromethyl)-1,3-diazinan-2-one
Also Known As: 5-acetyl-4-hydroxy-6-(3-methylphenyl)-4-(trifluoromethyl)-1,3-diazinan-2-one, AB00673562-01, F1168-0222, 5-acetyl-4-hydroxy-6-(m-tolyl)-4-(trifluoromethyl)tetrahydropyrimidin-2(1H)-one, 5-acetyl-4-hydroxy-6-(m-tolyl)-4-(trifluoromethyl)tetrahydro-2(1H)-pyrimidinone
| Molecular Formula | C14H15F3N2O3 |
|---|---|
| Molecular Weight | 316.10 g/mol |
| LogP | 1.80502 |
| Topological Polar Surface Area | 78.43 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 316.1035 |
| Heavy Atoms | 22 |
| Complexity | 617.59576 |
Chemical Identifiers
| CAS Number | 1005286-99-6 |
|---|---|
| SMILES | CC1=CC(=CC=C1)C2C(C(NC(=O)N2)(C(F)(F)F)O)C(=O)C |
Product Overview
5-Acetyl-4-hydroxy-6-(3-methylphenyl)-4-(trifluoromethyl)-1,3-diazinan-2-one (CAS 1005286-99-6), with molecular formula C14H15F3N2O3 and molecular weight 316.10 g/mol. IUPAC: 5-acetyl-4-hydroxy-6-(3-methylphenyl)-4-(trifluoromethyl)-1,3-diazinan-2-one.
Chemical Property Profile of 5-Acetyl-4-hydroxy-6-(3-methylphenyl)-4-(trifluoromethyl)-1,3-diazinan-2-one
Property Insights of 5-Acetyl-4-hydroxy-6-(3-methylphenyl)-4-(trifluoromethyl)-1,3-diazinan-2-one
The XLogP value of 1.80502 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Acetyl-4-hydroxy-6-(3-methylphenyl)-4-(trifluoromethyl)-1,3-diazinan-2-one. The TPSA of 78.43 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Acetyl-4-hydroxy-6-(3-methylphenyl)-4-(trifluoromethyl)-1,3-diazinan-2-one. Following Lipinski's Rule of Five, 5-Acetyl-4-hydroxy-6-(3-methylphenyl)-4-(trifluoromethyl)-1,3-diazinan-2-one has 3 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 5-Acetyl-4-hydroxy-6-(3-methylphenyl)-4-(trifluoromethyl)-1,3-diazinan-2-one?
The CAS number of 5-Acetyl-4-hydroxy-6-(3-methylphenyl)-4-(trifluoromethyl)-1,3-diazinan-2-one is 1005286-99-6.
What is the molecular formula of 5-Acetyl-4-hydroxy-6-(3-methylphenyl)-4-(trifluoromethyl)-1,3-diazinan-2-one?
The molecular formula of 5-Acetyl-4-hydroxy-6-(3-methylphenyl)-4-(trifluoromethyl)-1,3-diazinan-2-one is C14H15F3N2O3.
What is the molecular weight of 5-Acetyl-4-hydroxy-6-(3-methylphenyl)-4-(trifluoromethyl)-1,3-diazinan-2-one?
The molecular weight of 5-Acetyl-4-hydroxy-6-(3-methylphenyl)-4-(trifluoromethyl)-1,3-diazinan-2-one is 316.10 g/mol.
Where can I buy 5-Acetyl-4-hydroxy-6-(3-methylphenyl)-4-(trifluoromethyl)-1,3-diazinan-2-one?
You can request a quote for 5-Acetyl-4-hydroxy-6-(3-methylphenyl)-4-(trifluoromethyl)-1,3-diazinan-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Acetyl-4-hydroxy-6-(3-methylphenyl)-4-(trifluoromethyl)-1,3-diazinan-2-one?
Yes, KEHONG BIO provides custom synthesis services for 5-Acetyl-4-hydroxy-6-(3-methylphenyl)-4-(trifluoromethyl)-1,3-diazinan-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.