3-(3-methylphenyl)-1,4-diazaspiro[4.4]non-3-ene-2-thione

3-(3-methylphenyl)-1,4-diazaspiro[4.4]non-3-ene-2-thione

Formula: C14H16N2S

SMILES: CC1=CC=CC(=C1)C1=NC2(CCCC2)NC1=S

IUPAC: 3-(3-methylphenyl)-1,4-diazaspiro[4.4]non-3-ene-2-thione

InChI: InChI=1S/C14H16N2S/c1-10-5-4-6-11(9-10)12-13(17)16-14(15-12)7-2-3-8-14/h4-6,9H,2-3,7-8H2,1H3,(H,16,17)

Composition: C (68.82%), H (6.60%), N (11.46%), S (13.12%)

Molar Mass: 244.36

Atom Count: 33

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	244.103419697
Formal Charge	0
FSP3	0.43
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
InChIKey	AKCBRJKYGBYGIZ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	74.8
Topological Polar Surface Area	24.39
Polarizability	28.85
Ring Count	3
Rotatable Bond Count	1

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C14H16N2S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00