5,5-dimethyl-3-(4-phenylpiperazin-1-yl)cyclohex-2-en-1-one

5,5-dimethyl-3-(4-phenylpiperazin-1-yl)cyclohex-2-en-1-one

CAS: 81820-98-6

Formula: C18H24N2O

SMILES: CC1(C)CC(=O)C=C(C1)N1CCN(CC1)C1=CC=CC=C1

IUPAC: 5,5-dimethyl-3-(4-phenylpiperazin-1-yl)cyclohex-2-en-1-one

InChI: InChI=1S/C18H24N2O/c1-18(2)13-16(12-17(21)14-18)20-10-8-19(9-11-20)15-6-4-3-5-7-15/h3-7,12H,8-11,13-14H2,1-2H3

Composition: C (76.02%), H (8.51%), N (9.85%), O (5.63%)

Molar Mass: 284.403

Atom Count: 45

Heavy Atom Count: 21

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	284.188863401
Formal Charge	0
FSP3	0.5
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	HJDZMCJYXPLRJR-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	88.69
Topological Polar Surface Area	23.55
Polarizability	33.09
Ring Count	3
Rotatable Bond Count	2

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90%	<2 Days	81820-98-6		$51.35-$86.31$51.35$63.37$86.31