2-(4-chlorophenyl)-5-methyl-5-(2-methylpropyl)-1,2,4-triazolidine-3-thione

2-(4-chlorophenyl)-5-methyl-5-(2-methylpropyl)-1,2,4-triazolidine-3-thione

Formula: C13H18ClN3S

SMILES: CC(C)CC1(C)NN(C(=S)N1)C1=CC=C(Cl)C=C1

IUPAC: 2-(4-chlorophenyl)-5-methyl-5-(2-methylpropyl)-1,2,4-triazolidine-3-thione

InChI: InChI=1/C13H18ClN3S/c1-9(2)8-13(3)15-12(18)17(16-13)11-6-4-10(14)5-7-11/h4-7,9,16H,8H2,1-3H3,(H,15,18)

Composition: C (55.02%), H (6.39%), Cl (12.49%), N (14.81%), S (11.30%)

Molar Mass: 283.82

Atom Count: 36

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	1
Exact Mass	283.0909965
Formal Charge	0
FSP3	0.46
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	2
InChIKey	OMICCYZZXIQVSP-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	90.64
Topological Polar Surface Area	27.3
Polarizability	31.48
Ring Count	2
Rotatable Bond Count	3

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C13H18ClN3S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00