2,4-dichloro-N-({[(2-nitrophenyl)formamido]methanethioyl}amino)benzamide

2,4-dichloro-N-({[(2-nitrophenyl)formamido]methanethioyl}amino)benzamide

Formula: C15H10Cl2N4O4S

SMILES: [O-][N+](=O)C1=CC=CC=C1C(=O)NC(=S)NNC(=O)C1=CC=C(Cl)C=C1Cl

IUPAC: 2,4-dichloro-N-({[(2-nitrophenyl)formamido]methanethioyl}amino)benzamide

InChI: InChI=1S/C15H10Cl2N4O4S/c16-8-5-6-9(11(17)7-8)14(23)19-20-15(26)18-13(22)10-3-1-2-4-12(10)21(24)25/h1-7H,(H,19,23)(H2,18,20,22,26)

Composition: C (43.60%), H (2.44%), Cl (17.16%), N (13.56%), O (15.49%), S (7.76%)

Molar Mass: 413.23

Atom Count: 36

Heavy Atom Count: 26

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	411.9799814
Formal Charge	0
FSP3	0
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	3
InChIKey	KTFWGNFKFRWGPO-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	100.84
Topological Polar Surface Area	113.37
Polarizability	37.81
Ring Count	2
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C15H10Cl2N4O4S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00