F9994-0105
Product ID:
F9994-0105
Collection: Screening compounds
C13H9F3N2O
CAS RN
871592-89-1
Formula
C13H9F3N2O
Purity90%Statesolid
IUPAC name
4-[(E)-2-phenylethenyl]-6-(trifluoromethyl)-1,2-dihydropyrimidin-2-one
SMILES
O=c1nc(/C=C/c2ccccc2)cc(C(F)(F)F)[nH]1
InChi
InChI=1S/C13H9F3N2O/c14-13(15,16)11-8-10(17-12(19)18-11)7-6-9-4-2-1-3-5-9/h1-8H,(H,17,18,19)/b7-6+
InChi Key
RELDXDDLPBWBDF-VOTSOKGWSA-N
MW266.22 [46.07...1702.72]
radaChart
Fsp30.08 [0...1.00]
cLogP2.25 [-11.42...28.50]
cLogSw-4.30 [-19.49...5.44]
TPSA41.46 [0...519.07]
HBD1 [0...10]
HBA2 [0...28]
ROTB2 [0...72]
AROM2 [0...16]
DL0.91 [0.02...0.95]
ChemDiversity Phenotypic Library
Chemoinformatic Clustered Compound Library
CNS Focused Screening Library
Fluorine Fragment Library
Fragment Library with Experimental Solubility
General Fragment Library Main collection
UA stock: 89.3 mg
Delivery in 2-3 weeks
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Substructure Analogs
Product ID:
F9994-0105
Collection: Screening compounds
C13H9F3N2O
MW: 266.22
CAS: 871592-89-1
Purity: 90%
UA stock: 89.3 mg
EU stock: 0 mg
US stock: 0 mg
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US stock: 0 mg
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Product ID:
F9994-0105
Collection: Screening compounds
C13H9F3N2O
MW: 266.22
CAS: 871592-89-1
Purity: 90%
UA stock: 89.3 mg
EU stock: 0 mg
US stock: 0 mg