N-benzyl-2-({4-methyl-5-[2-(methylsulfanyl)ethyl]-1H-imidazol-2-yl}sulfanyl)acetamide

N-benzyl-2-({4-methyl-5-[2-(methylsulfanyl)ethyl]-1H-imidazol-2-yl}sulfanyl)acetamide

Formula: C16H21N3OS2

SMILES: CSCCC1=C(C)N=C(N1)SCC(=O)NCC1=CC=CC=C1

IUPAC: N-benzyl-2-({4-methyl-5-[2-(methylsulfanyl)ethyl]-1H-imidazol-2-yl}sulfanyl)acetamide

InChI: InChI=1S/C16H21N3OS2/c1-12-14(8-9-21-2)19-16(18-12)22-11-15(20)17-10-13-6-4-3-5-7-13/h3-7H,8-11H2,1-2H3,(H,17,20)(H,18,19)

Composition: C (57.28%), H (6.31%), N (12.53%), O (4.77%), S (19.11%)

Molar Mass: 335.48

Atom Count: 43

Heavy Atom Count: 22

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	335.112604656
Formal Charge	0
FSP3	0.37
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	ATMJENWKEPXFCK-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	95.64
Topological Polar Surface Area	57.78
Polarizability	36.8
Ring Count	2
Rotatable Bond Count	8

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C16H21N3OS2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00