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7-(3-bromophenyl)-5-phenyl-4H,5H,6H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-2-amine

7-(3-bromophenyl)-5-phenyl-4H,5H,6H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-2-amine

Formula: C17H16BrN5

SMILES: NC1=NN2C(CC(NC2=N1)C1=CC=CC=C1)C1=CC(Br)=CC=C1

IUPAC: 7-(3-bromophenyl)-5-phenyl-4H,5H,6H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-2-amine

InChI: InChI=1/C17H16BrN5/c18-13-8-4-7-12(9-13)15-10-14(11-5-2-1-3-6-11)20-17-21-16(19)22-23(15)17/h1-9,14-15H,10H2,(H3,19,20,21,22)

Composition: C (55.15%), H (4.36%), Br (21.58%), N (18.92%)

Molar Mass: 370.254

Atom Count: 39

Heavy Atom Count: 23

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 2
Exact Mass 369.058909
Formal Charge 0
FSP3 0.18
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 2
InChIKey NFOFRZXIJUXEMG-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 107.53
Topological Polar Surface Area 68.76
Polarizability 35.15
Ring Count 4
Rotatable Bond Count 2

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Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C17H16BrN5 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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