N-(3-{[(naphthalen-1-ylformamido)methanethioyl]amino}phenyl)benzamide

N-(3-{[(naphthalen-1-ylformamido)methanethioyl]amino}phenyl)benzamide

Formula: C25H19N3O2S

SMILES: O=C(NC(=S)NC1=CC=CC(NC(=O)C2=CC=CC=C2)=C1)C1=CC=CC2=CC=CC=C12

IUPAC: N-[3-({[(naphthalen-1-yl)formamido]methanethioyl}amino)phenyl]benzamide

InChI: InChI=1S/C25H19N3O2S/c29-23(18-9-2-1-3-10-18)26-19-12-7-13-20(16-19)27-25(31)28-24(30)22-15-6-11-17-8-4-5-14-21(17)22/h1-16H,(H,26,29)(H2,27,28,30,31)

Composition: C (70.57%), H (4.50%), N (9.88%), O (7.52%), S (7.53%)

Molar Mass: 425.51

Atom Count: 50

Heavy Atom Count: 31

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	0
Exact Mass	425.119798038
Formal Charge	0
FSP3	0
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	3
InChIKey	KVNGDSMNEWPQSK-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	129.81
Topological Polar Surface Area	70.23
Polarizability	49.34
Ring Count	4
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C25H19N3O2S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00