3-chloro-N-[3-nitro-5-(pyridin-3-yloxy)phenyl]-1-benzothiophene-2-carboxamide

3-chloro-N-[3-nitro-5-(pyridin-3-yloxy)phenyl]-1-benzothiophene-2-carboxamide

Formula: C20H12ClN3O4S

SMILES: [O-][N+](=O)C1=CC(NC(=O)C2=C(Cl)C3=CC=CC=C3S2)=CC(OC2=CC=CN=C2)=C1

IUPAC: 3-chloro-N-[3-nitro-5-(pyridin-3-yloxy)phenyl]-1-benzothiophene-2-carboxamide

InChI: InChI=1S/C20H12ClN3O4S/c21-18-16-5-1-2-6-17(16)29-19(18)20(25)23-12-8-13(24(26)27)10-15(9-12)28-14-4-3-7-22-11-14/h1-11H,(H,23,25)

Composition: C (56.41%), H (2.84%), Cl (8.32%), N (9.87%), O (15.03%), S (7.53%)

Molar Mass: 425.84

Atom Count: 41

Heavy Atom Count: 29

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	0
Exact Mass	425.0237048
Formal Charge	0
FSP3	0
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	KCFXYDAPFNMZFU-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	109.92
Topological Polar Surface Area	94.36
Polarizability	42.35
Ring Count	4
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C20H12ClN3O4S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00