2-(2,3-dimethylphenyl)-5-ethyl-5-phenyl-1,2,4-triazolidine-3-thione

2-(2,3-dimethylphenyl)-5-ethyl-5-phenyl-1,2,4-triazolidine-3-thione

Formula: C18H21N3S

SMILES: CCC1(NN(C(=S)N1)C1=CC=CC(C)=C1C)C1=CC=CC=C1

IUPAC: 2-(2,3-dimethylphenyl)-5-ethyl-5-phenyl-1,2,4-triazolidine-3-thione

InChI: InChI=1/C18H21N3S/c1-4-18(15-10-6-5-7-11-15)19-17(22)21(20-18)16-12-8-9-13(2)14(16)3/h5-12,20H,4H2,1-3H3,(H,19,22)

Composition: C (69.42%), H (6.80%), N (13.49%), S (10.29%)

Molar Mass: 311.45

Atom Count: 43

Heavy Atom Count: 22

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	1
Exact Mass	311.145618862
Formal Charge	0
FSP3	0.28
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	2
InChIKey	GEEWVEUUFRCQEK-UHFFFAOYNA-N
Lipinski's Rule of Five
Molar Refractivity	106.47
Topological Polar Surface Area	27.3
Polarizability	37.27
Ring Count	3
Rotatable Bond Count	3

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C18H21N3S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00