4-methyl-2-[(2-methylprop-2-en-1-yl)sulfanyl]-1H-1,3-benzodiazole

4-methyl-2-[(2-methylprop-2-en-1-yl)sulfanyl]-1H-1,3-benzodiazole

Formula: C12H14N2S

SMILES: CC(=C)CSC1=NC2=C(C)C=CC=C2N1

IUPAC: 4-methyl-2-[(2-methylprop-2-en-1-yl)sulfanyl]-1H-1,3-benzodiazole

InChI: InChI=1S/C12H14N2S/c1-8(2)7-15-12-13-10-6-4-5-9(3)11(10)14-12/h4-6H,1,7H2,2-3H3,(H,13,14)

Composition: C (66.02%), H (6.46%), N (12.83%), S (14.69%)

Molar Mass: 218.32

Atom Count: 29

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	218.087769633
Formal Charge	0
FSP3	0.25
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
InChIKey	YEABUUIDNKJEBG-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	65.74
Topological Polar Surface Area	28.68
Polarizability	26.67
Ring Count	2
Rotatable Bond Count	3

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C12H14N2S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00