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

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

Formula: C19H15FN4O2

SMILES: COC(=O)C1C(N2N=CN=C2N=C1C1=CC=CC=C1)C1=CC=CC=C1F

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

InChI: InChI=1/C19H15FN4O2/c1-26-18(25)15-16(12-7-3-2-4-8-12)23-19-21-11-22-24(19)17(15)13-9-5-6-10-14(13)20/h2-11,15,17H,1H3

Composition: C (65.14%), H (4.32%), F (5.42%), N (15.99%), O (9.13%)

Molar Mass: 350.353

Atom Count: 41

Heavy Atom Count: 26

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 2
Exact Mass 350.117903902
Formal Charge 0
FSP3 0.16
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 0
InChIKey DUSICCCHZOHVKO-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 106.46
Topological Polar Surface Area 69.37
Polarizability 35.08
Ring Count 4
Rotatable Bond Count 4

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Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C19H15FN4O2 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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