N-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]benzamide

N-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]benzamide

Formula: C16H13N3OS2

SMILES: O=C(NC1=NN=C(SCC2=CC=CC=C2)S1)C1=CC=CC=C1

IUPAC: N-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]benzamide

InChI: InChI=1S/C16H13N3OS2/c20-14(13-9-5-2-6-10-13)17-15-18-19-16(22-15)21-11-12-7-3-1-4-8-12/h1-10H,11H2,(H,17,18,20)

Composition: C (58.69%), H (4.00%), N (12.83%), O (4.89%), S (19.58%)

Molar Mass: 327.42

Atom Count: 35

Heavy Atom Count: 22

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	327.050004399
Formal Charge	0
FSP3	0.06
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	PVUYLUYGUIIBEU-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	93.29
Topological Polar Surface Area	54.88
Polarizability	34.38
Ring Count	3
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C16H13N3OS2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00