N-{5-[(1E)-2-(4-methoxyphenyl)ethenyl]-1,3,4-thiadiazol-2-yl}pentanamide

N-{5-[(1E)-2-(4-methoxyphenyl)ethenyl]-1,3,4-thiadiazol-2-yl}pentanamide

Formula: C16H19N3O2S

SMILES: CCCCC(=O)NC1=NN=C(S1)C=CC1=CC=C(OC)C=C1

IUPAC: N-{5-[(1E)-2-(4-methoxyphenyl)ethenyl]-1,3,4-thiadiazol-2-yl}pentanamide

InChI: InChI=1S/C16H19N3O2S/c1-3-4-5-14(20)17-16-19-18-15(22-16)11-8-12-6-9-13(21-2)10-7-12/h6-11H,3-5H2,1-2H3,(H,17,19,20)/b11-8+

Composition: C (60.55%), H (6.03%), N (13.24%), O (10.08%), S (10.10%)

Molar Mass: 317.41

Atom Count: 41

Heavy Atom Count: 22

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	317.119798038
Formal Charge	0
FSP3	0.31
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	ZCCFRPHKOMGCMX-DHZHZOJOSA-N
Lipinski's Rule of Five	1
Molar Refractivity	90.87
Topological Polar Surface Area	64.11
Polarizability	33.22
Ring Count	2
Rotatable Bond Count	7

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C16H19N3O2S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00