N'-(3,4-dimethylphenyl)-N-[(methylcarbamothioyl)amino]propanediamide

N'-(3,4-dimethylphenyl)-N-[(methylcarbamothioyl)amino]propanediamide

Formula: C13H18N4O2S

SMILES: CNC(=S)NNC(=O)CC(=O)NC1=CC=C(C)C(C)=C1

IUPAC: N'-(3,4-dimethylphenyl)-N-[(methylcarbamothioyl)amino]propanediamide

InChI: InChI=1S/C13H18N4O2S/c1-8-4-5-10(6-9(8)2)15-11(18)7-12(19)16-17-13(20)14-3/h4-6H,7H2,1-3H3,(H,15,18)(H,16,19)(H2,14,17,20)

Composition: C (53.04%), H (6.16%), N (19.03%), O (10.87%), S (10.89%)

Molar Mass: 294.37

Atom Count: 38

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	294.11504701
Formal Charge	0
FSP3	0.31
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	4
InChIKey	MVYUXDKCNDQZIG-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	83.6
Topological Polar Surface Area	82.26
Polarizability	31.19
Ring Count	1
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C13H18N4O2S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00