1-(2,4-dimethoxy-3-methylbenzenesulfinyl)-4-methylpiperazine

1-(2,4-dimethoxy-3-methylbenzenesulfinyl)-4-methylpiperazine

CAS: 338981-90-1

Formula: C14H22N2O3S

SMILES: COC1=C(C)C(OC)=C(C=C1)S(=O)N1CCN(C)CC1

IUPAC: 1-(2,4-dimethoxy-3-methylbenzenesulfinyl)-4-methylpiperazine

InChI: InChI=1/C14H22N2O3S/c1-11-12(18-3)5-6-13(14(11)19-4)20(17)16-9-7-15(2)8-10-16/h5-6H,7-10H2,1-4H3

Composition: C (56.35%), H (7.43%), N (9.39%), O (16.08%), S (10.74%)

Molar Mass: 298.4

Atom Count: 42

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	1
Exact Mass	298.13511375
Formal Charge	0
FSP3	0.57
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	NKCRPFMEWBRNDP-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	82.55
Topological Polar Surface Area	42.01
Polarizability	31.87
Ring Count	2
Rotatable Bond Count	3

Suppliers

Key Organics Ltd

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
90%	<2 Days	338981-90-1		$51.35-$86.31$51.35$63.37$86.31