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7-(4-methoxyphenyl)-5-phenyl-6H,7H-[1,2,4]triazolo[1,5-a]pyrimidine

7-(4-methoxyphenyl)-5-phenyl-6H,7H-[1,2,4]triazolo[1,5-a]pyrimidine

Formula: C18H16N4O

SMILES: COC1=CC=C(C=C1)C1CC(=NC2=NC=NN12)C1=CC=CC=C1

IUPAC: 7-(4-methoxyphenyl)-5-phenyl-6H,7H-[1,2,4]triazolo[1,5-a]pyrimidine

InChI: InChI=1/C18H16N4O/c1-23-15-9-7-14(8-10-15)17-11-16(13-5-3-2-4-6-13)21-18-19-12-20-22(17)18/h2-10,12,17H,11H2,1H3

Composition: C (71.04%), H (5.30%), N (18.41%), O (5.26%)

Molar Mass: 304.353

Atom Count: 39

Heavy Atom Count: 23

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 1
Exact Mass 304.132411151
Formal Charge 0
FSP3 0.17
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 0
InChIKey KTFWCEARIKTWHS-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 101.64
Topological Polar Surface Area 52.3
Polarizability 33.37
Ring Count 4
Rotatable Bond Count 3

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Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C18H16N4O $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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