1-{2-[3-(4-fluorophenyl)-1H-pyrazol-4-yl]ethyl}-4-methylpiperazine

1-{2-[3-(4-fluorophenyl)-1H-pyrazol-4-yl]ethyl}-4-methylpiperazine

CAS: 1007071-72-8

Formula: C16H21FN4

SMILES: CN1CCN(CCC2=CNN=C2C2=CC=C(F)C=C2)CC1

IUPAC: 1-{2-[3-(4-fluorophenyl)-1H-pyrazol-4-yl]ethyl}-4-methylpiperazine

InChI: InChI=1S/C16H21FN4/c1-20-8-10-21(11-9-20)7-6-14-12-18-19-16(14)13-2-4-15(17)5-3-13/h2-5,12H,6-11H2,1H3,(H,18,19)

Composition: C (66.64%), H (7.34%), F (6.59%), N (19.43%)

Molar Mass: 288.37

Atom Count: 42

Heavy Atom Count: 21

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	288.175024855
Formal Charge	0
FSP3	0.44
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	GBEXOUIIUXCLAK-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	84.07
Topological Polar Surface Area	35.16
Polarizability	32.87
Ring Count	3
Rotatable Bond Count	4

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90%	<2 Days	1007071-72-8		$51.35-$86.31$51.35$63.37$86.31