N-benzyl-N-{2-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]phenyl}methanesulfonamide

N-benzyl-N-{2-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]phenyl}methanesulfonamide

Formula: C27H31N3O3S

SMILES: CC1=C(C)C(=CC=C1)N1CCN(CC1)C(=O)C1=CC=CC=C1N(CC1=CC=CC=C1)S(C)(=O)=O

IUPAC: N-benzyl-N-{2-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]phenyl}methanesulfonamide

InChI: InChI=1S/C27H31N3O3S/c1-21-10-9-15-25(22(21)2)28-16-18-29(19-17-28)27(31)24-13-7-8-14-26(24)30(34(3,32)33)20-23-11-5-4-6-12-23/h4-15H,16-20H2,1-3H3

Composition: C (67.90%), H (6.54%), N (8.80%), O (10.05%), S (6.71%)

Molar Mass: 477.62

Atom Count: 65

Heavy Atom Count: 34

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	477.208613044
Formal Charge	0
FSP3	0.3
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	JQJFWIZJWCVLNU-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	137.75
Topological Polar Surface Area	60.93
Polarizability	52.64
Ring Count	4
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C27H31N3O3S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00