5-(3-fluoro-4-methoxyphenyl)-6-methyl-3-phenylpyrazolo[1,5-a]pyrimidine

5-(3-fluoro-4-methoxyphenyl)-6-methyl-3-phenylpyrazolo[1,5-a]pyrimidine

CAS: 861207-37-6

Formula: C20H16FN3O

SMILES: COC1=C(F)C=C(C=C1)C1=NC2=C(C=NN2C=C1C)C1=CC=CC=C1

IUPAC: 5-(3-fluoro-4-methoxyphenyl)-6-methyl-3-phenylpyrazolo[1,5-a]pyrimidine

InChI: InChI=1S/C20H16FN3O/c1-13-12-24-20(16(11-22-24)14-6-4-3-5-7-14)23-19(13)15-8-9-18(25-2)17(21)10-15/h3-12H,1-2H3

Composition: C (72.06%), H (4.84%), F (5.70%), N (12.61%), O (4.80%)

Molar Mass: 333.366

Atom Count: 41

Heavy Atom Count: 25

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	0
Exact Mass	333.12774031
Formal Charge	0
FSP3	0.1
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	PFAKRWMTYUTCIK-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	105.39
Topological Polar Surface Area	39.42
Polarizability	38.25
Ring Count	4
Rotatable Bond Count	3

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