(E)-6-(2-(dimethylamino)vinyl)-5-nitro-4-(2-(trifluoromethyl)phenyl)-3,4-dihydropyrimidin-2(1H)-one
TL;DR: (E)-6-(2-(dimethylamino)vinyl)-5-nitro-4-(2-(trifluoromethyl)phenyl)-3,4-dihydropyrimidin-2(1H)-one (CAS 372175-35-4) is a chemical compound with molecular formula C15H15F3N4O3 and molecular weight 356.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[(E)-2-(dimethylamino)ethenyl]-5-nitro-4-[2-(trifluoromethyl)phenyl]-3,4-dihydro-1H-pyrimidin-2-one
Also Known As: (E)-6-(2-(dimethylamino)vinyl)-5-nitro-4-(2-(trifluoromethyl)phenyl)-3,4-dihydropyrimidin-2(1H)-one, 4-(2-dimethylaminoethenyl)-5-nitro-6-[2-(trifluoromethyl)phenyl]-3,6-dihydro-1H-pyrimidin-2-one, 6-[(E)-2-(dimethylamino)ethenyl]-5-nitro-4-[2-(trifluoromethyl)phenyl]-3,4-dihydro-1H-pyrimidin-2-one
| Molecular Formula | C15H15F3N4O3 |
|---|---|
| Molecular Weight | 356.11 g/mol |
| LogP | 2.6229 |
| Topological Polar Surface Area | 87.51 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 356.10962 |
| Heavy Atoms | 25 |
| Complexity | 756.6336 |
Chemical Identifiers
| CAS Number | 372175-35-4 |
|---|---|
| SMILES | CN(C)/C=C/C1=C(C(NC(=O)N1)C2=CC=CC=C2C(F)(F)F)[N+](=O)[O-] |
Product Overview
(E)-6-(2-(dimethylamino)vinyl)-5-nitro-4-(2-(trifluoromethyl)phenyl)-3,4-dihydropyrimidin-2(1H)-one (CAS 372175-35-4), with molecular formula C15H15F3N4O3 and molecular weight 356.11 g/mol. IUPAC: 6-[(E)-2-(dimethylamino)ethenyl]-5-nitro-4-[2-(trifluoromethyl)phenyl]-3,4-dihydro-1H-pyrimidin-2-one.
Chemical Property Profile of (E)-6-(2-(dimethylamino)vinyl)-5-nitro-4-(2-(trifluoromethyl)phenyl)-3,4-dihydropyrimidin-2(1H)-one
Property Insights of (E)-6-(2-(dimethylamino)vinyl)-5-nitro-4-(2-(trifluoromethyl)phenyl)-3,4-dihydropyrimidin-2(1H)-one
The XLogP value of 2.6229 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-6-(2-(dimethylamino)vinyl)-5-nitro-4-(2-(trifluoromethyl)phenyl)-3,4-dihydropyrimidin-2(1H)-one. The TPSA of 87.51 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-6-(2-(dimethylamino)vinyl)-5-nitro-4-(2-(trifluoromethyl)phenyl)-3,4-dihydropyrimidin-2(1H)-one. Following Lipinski's Rule of Five, (E)-6-(2-(dimethylamino)vinyl)-5-nitro-4-(2-(trifluoromethyl)phenyl)-3,4-dihydropyrimidin-2(1H)-one has 2 hydrogen bond donor(s) and 4 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 (E)-6-(2-(dimethylamino)vinyl)-5-nitro-4-(2-(trifluoromethyl)phenyl)-3,4-dihydropyrimidin-2(1H)-one?
The CAS number of (E)-6-(2-(dimethylamino)vinyl)-5-nitro-4-(2-(trifluoromethyl)phenyl)-3,4-dihydropyrimidin-2(1H)-one is 372175-35-4.
What is the molecular formula of (E)-6-(2-(dimethylamino)vinyl)-5-nitro-4-(2-(trifluoromethyl)phenyl)-3,4-dihydropyrimidin-2(1H)-one?
The molecular formula of (E)-6-(2-(dimethylamino)vinyl)-5-nitro-4-(2-(trifluoromethyl)phenyl)-3,4-dihydropyrimidin-2(1H)-one is C15H15F3N4O3.
What is the molecular weight of (E)-6-(2-(dimethylamino)vinyl)-5-nitro-4-(2-(trifluoromethyl)phenyl)-3,4-dihydropyrimidin-2(1H)-one?
The molecular weight of (E)-6-(2-(dimethylamino)vinyl)-5-nitro-4-(2-(trifluoromethyl)phenyl)-3,4-dihydropyrimidin-2(1H)-one is 356.11 g/mol.
Where can I buy (E)-6-(2-(dimethylamino)vinyl)-5-nitro-4-(2-(trifluoromethyl)phenyl)-3,4-dihydropyrimidin-2(1H)-one?
You can request a quote for (E)-6-(2-(dimethylamino)vinyl)-5-nitro-4-(2-(trifluoromethyl)phenyl)-3,4-dihydropyrimidin-2(1H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-6-(2-(dimethylamino)vinyl)-5-nitro-4-(2-(trifluoromethyl)phenyl)-3,4-dihydropyrimidin-2(1H)-one?
Yes, KEHONG BIO provides custom synthesis services for (E)-6-(2-(dimethylamino)vinyl)-5-nitro-4-(2-(trifluoromethyl)phenyl)-3,4-dihydropyrimidin-2(1H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.