N-[5-(phenoxymethyl)-1,3,4-thiadiazol-2-yl]-2-[(6-phenyl-1,2,4-triazin-3-yl)sulfanyl]acetamide

N-[5-(phenoxymethyl)-1,3,4-thiadiazol-2-yl]-2-[(6-phenyl-1,2,4-triazin-3-yl)sulfanyl]acetamide

Formula: C20H16N6O2S2

SMILES: O=C(CSC1=NC=C(N=N1)C1=CC=CC=C1)NC1=NN=C(COC2=CC=CC=C2)S1

IUPAC: N-[5-(phenoxymethyl)-1,3,4-thiadiazol-2-yl]-2-[(6-phenyl-1,2,4-triazin-3-yl)sulfanyl]acetamide

InChI: InChI=1S/C20H16N6O2S2/c27-17(13-29-19-21-11-16(23-25-19)14-7-3-1-4-8-14)22-20-26-24-18(30-20)12-28-15-9-5-2-6-10-15/h1-11H,12-13H2,(H,22,26,27)

Composition: C (55.03%), H (3.69%), N (19.25%), O (7.33%), S (14.69%)

Molar Mass: 436.51

Atom Count: 46

Heavy Atom Count: 30

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	0
Exact Mass	436.077616127
Formal Charge	0
FSP3	0.1
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	1
InChIKey	JDNYSICCRGZVAL-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	119.77
Topological Polar Surface Area	102.78
Polarizability	45.22
Ring Count	4
Rotatable Bond Count	8

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C20H16N6O2S2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00