N-[3-fluoro-4-(4-methylpiperazin-1-yl)phenyl]-3-methylbenzamide

N-[3-fluoro-4-(4-methylpiperazin-1-yl)phenyl]-3-methylbenzamide

CAS: 478079-60-6

Formula: C19H22FN3O

SMILES: CN1CCN(CC1)C1=C(F)C=C(NC(=O)C2=CC(C)=CC=C2)C=C1

IUPAC: N-[3-fluoro-4-(4-methylpiperazin-1-yl)phenyl]-3-methylbenzamide

InChI: InChI=1S/C19H22FN3O/c1-14-4-3-5-15(12-14)19(24)21-16-6-7-18(17(20)13-16)23-10-8-22(2)9-11-23/h3-7,12-13H,8-11H2,1-2H3,(H,21,24)

Composition: C (69.70%), H (6.77%), F (5.80%), N (12.83%), O (4.89%)

Molar Mass: 327.403

Atom Count: 46

Heavy Atom Count: 24

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	327.174690503
Formal Charge	0
FSP3	0.32
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	AZYDRNFYSUPDHW-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	97.33
Topological Polar Surface Area	35.58
Polarizability	35.49
Ring Count	3
Rotatable Bond Count	3

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Purity	LeadTime	CAS	PacketSize	UnitPrice
90%	<2 Days	478079-60-6		$51.35-$86.31$51.35$63.37$86.31