N-[4-({[(3-methyl-1-benzofuran-2-yl)formamido]methanethioyl}amino)phenyl]propanamide

N-[4-({[(3-methyl-1-benzofuran-2-yl)formamido]methanethioyl}amino)phenyl]propanamide

Formula: C20H19N3O3S

SMILES: CCC(=O)NC1=CC=C(NC(=S)NC(=O)C2=C(C)C3=CC=CC=C3O2)C=C1

IUPAC: N-[4-({[(3-methyl-1-benzofuran-2-yl)formamido]methanethioyl}amino)phenyl]propanamide

InChI: InChI=1S/C20H19N3O3S/c1-3-17(24)21-13-8-10-14(11-9-13)22-20(27)23-19(25)18-12(2)15-6-4-5-7-16(15)26-18/h4-11H,3H2,1-2H3,(H,21,24)(H2,22,23,25,27)

Composition: C (62.98%), H (5.02%), N (11.02%), O (12.58%), S (8.40%)

Molar Mass: 381.45

Atom Count: 46

Heavy Atom Count: 27

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	381.114712658
Formal Charge	0
FSP3	0.15
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	3
InChIKey	BFOKZJIZMBWBBL-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	111.07
Topological Polar Surface Area	83.37
Polarizability	42.04
Ring Count	3
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C20H19N3O3S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00