RefChem:299924
TL;DR: RefChem:299924 (CAS 1005068-68-7) is a chemical compound with molecular formula C19H16F4N2O4 and molecular weight 412.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(4-fluorobenzoyl)-4-hydroxy-6-(4-methoxyphenyl)-4-(trifluoromethyl)-1,3-diazinan-2-one
Also Known As: 5-(4-fluorobenzoyl)-4-hydroxy-6-(4-methoxyphenyl)-4-(trifluoromethyl)-1,3-diazinan-2-one, 2(1H)-Pyrimidinone, 5-(4-fluorobenzoyl)tetrahydro-4-hydroxy-6-(4-methoxyphenyl)-4-(trifluoromethyl)-, 5-(4-Fluorobenzoyl)tetrahydro-4-hydroxy-6-(4-methoxyphenyl)-4-(trifluoromethyl)-2(1H)-pyrimidinone, 5-(4-fluorobenzoyl)-4-hydroxy-6-(4-methoxyphenyl)-4-(trifluoromethyl)tetrahydro-2(1H)-pyrimidinone, 5-(4-fluorobenzoyl)-4-hydroxy-6-(4-methoxyphenyl)-4-(trifluoromethyl)tetrahydropyrimidin-2(1H)-one
| Molecular Formula | C19H16F4N2O4 |
|---|---|
| Molecular Weight | 412.10 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 87.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 412.1046 |
| Heavy Atoms | 29 |
| Complexity | 616.0 |
Chemical Identifiers
| CAS Number | 1005068-68-7 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2C(C(NC(=O)N2)(C(F)(F)F)O)C(=O)C3=CC=C(C=C3)F |
| InChIKey | JLYNOMVNFPMSSJ-UHFFFAOYSA-N |
Product Overview
RefChem:299924 (CAS 1005068-68-7), with molecular formula C19H16F4N2O4 and molecular weight 412.10 g/mol. IUPAC: 5-(4-fluorobenzoyl)-4-hydroxy-6-(4-methoxyphenyl)-4-(trifluoromethyl)-1,3-diazinan-2-one.
Chemical Property Profile of RefChem:299924
Property Insights of RefChem:299924
The XLogP value of 3.1 indicates that RefChem:299924 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.7 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:299924. Following Lipinski's Rule of Five, RefChem:299924 has 3 hydrogen bond donor(s) and 8 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:299924?
The CAS number of RefChem:299924 is 1005068-68-7.
What is the molecular formula of RefChem:299924?
The molecular formula of RefChem:299924 is C19H16F4N2O4.
What is the molecular weight of RefChem:299924?
The molecular weight of RefChem:299924 is 412.10 g/mol.
Where can I buy RefChem:299924?
You can request a quote for RefChem:299924 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:299924?
Yes, KEHONG BIO provides custom synthesis services for RefChem:299924 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.