2-({[(2-iodophenyl)formamido]methanethioyl}amino)-4,5-dimethylthiophene-3-carboxamide

2-({[(2-iodophenyl)formamido]methanethioyl}amino)-4,5-dimethylthiophene-3-carboxamide

Formula: C15H14IN3O2S2

SMILES: CC1=C(C)C(C(N)=O)=C(NC(=S)NC(=O)C2=CC=CC=C2I)S1

IUPAC: 2-({[(2-iodophenyl)formamido]methanethioyl}amino)-4,5-dimethylthiophene-3-carboxamide

InChI: InChI=1S/C15H14IN3O2S2/c1-7-8(2)23-14(11(7)12(17)20)19-15(22)18-13(21)9-5-3-4-6-10(9)16/h3-6H,1-2H3,(H2,17,20)(H2,18,19,21,22)

Composition: C (39.22%), H (3.07%), I (27.63%), N (9.15%), O (6.97%), S (13.96%)

Molar Mass: 459.32

Atom Count: 37

Heavy Atom Count: 23

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	458.95721
Formal Charge	0
FSP3	0.13
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	3
InChIKey	BWEKSMZGDRTHIW-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	106.63
Topological Polar Surface Area	84.22
Polarizability	39.39
Ring Count	2
Rotatable Bond Count	3

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C15H14IN3O2S2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00