N-[4-({[(2-nitrophenyl)formamido]methanethioyl}amino)phenyl]acetamide

N-[4-({[(2-nitrophenyl)formamido]methanethioyl}amino)phenyl]acetamide

Formula: C16H14N4O4S

SMILES: CC(=O)NC1=CC=C(NC(=S)NC(=O)C2=CC=CC=C2[N+]([O-])=O)C=C1

IUPAC: N-[4-({[(2-nitrophenyl)formamido]methanethioyl}amino)phenyl]acetamide

InChI: InChI=1S/C16H14N4O4S/c1-10(21)17-11-6-8-12(9-7-11)18-16(25)19-15(22)13-4-2-3-5-14(13)20(23)24/h2-9H,1H3,(H,17,21)(H2,18,19,22,25)

Composition: C (53.62%), H (3.94%), N (15.63%), O (17.86%), S (8.95%)

Molar Mass: 358.37

Atom Count: 39

Heavy Atom Count: 25

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	358.073576121
Formal Charge	0
FSP3	0.06
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	3
InChIKey	OGKXZOFFFHQKHD-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	99.01
Topological Polar Surface Area	113.37
Polarizability	35.94
Ring Count	2
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C16H14N4O4S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00