1-(4-methylpyridin-2-yl)-3-(2-nitrobenzoyl)thiourea

1-(4-methylpyridin-2-yl)-3-(2-nitrobenzoyl)thiourea

Formula: C14H12N4O3S

SMILES: CC1=CC(NC(=S)NC(=O)C2=CC=CC=C2[N+]([O-])=O)=NC=C1

IUPAC: 1-(4-methylpyridin-2-yl)-3-(2-nitrobenzoyl)thiourea

InChI: InChI=1S/C14H12N4O3S/c1-9-6-7-15-12(8-9)16-14(22)17-13(19)10-4-2-3-5-11(10)18(20)21/h2-8H,1H3,(H2,15,16,17,19,22)

Composition: C (53.16%), H (3.82%), N (17.71%), O (15.17%), S (10.13%)

Molar Mass: 316.34

Atom Count: 34

Heavy Atom Count: 22

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	316.063011436
Formal Charge	0
FSP3	0.07
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
InChIKey	URPKJZLSGXIJNF-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	87.34
Topological Polar Surface Area	97.16
Polarizability	31.92
Ring Count	2
Rotatable Bond Count	3

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C14H12N4O3S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00