1-benzoyl-3-(3,5-dimethyl-1H-pyrazol-4-yl)thiourea

1-benzoyl-3-(3,5-dimethyl-1H-pyrazol-4-yl)thiourea

Formula: C13H14N4OS

SMILES: CC1=C(NC(=S)NC(=O)C2=CC=CC=C2)C(C)=NN1

IUPAC: 1-benzoyl-3-(3,5-dimethyl-1H-pyrazol-4-yl)thiourea

InChI: InChI=1S/C13H14N4OS/c1-8-11(9(2)17-16-8)14-13(19)15-12(18)10-6-4-3-5-7-10/h3-7H,1-2H3,(H,16,17)(H2,14,15,18,19)

Composition: C (56.92%), H (5.14%), N (20.42%), O (5.83%), S (11.69%)

Molar Mass: 274.34

Atom Count: 33

Heavy Atom Count: 19

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	274.088832261
Formal Charge	0
FSP3	0.15
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	3
InChIKey	ZMYRTFPYDFSDGX-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	81.25
Topological Polar Surface Area	69.81
Polarizability	29.5
Ring Count	2
Rotatable Bond Count	2

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C13H14N4OS		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00