2-{[5-(3,4-dimethoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl}-N'-[(1E)-1-(pyridin-4-yl)ethylidene]acetohydrazide

2-{[5-(3,4-dimethoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl}-N'-[(1E)-1-(pyridin-4-yl)ethylidene]acetohydrazide

Formula: C25H24N6O3S

SMILES: COC1=CC=C(C=C1OC)C1=NN=C(SCC(=O)NN=C(/C)C2=CC=NC=C2)N1C1=CC=CC=C1

IUPAC: 2-{[5-(3,4-dimethoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(1E)-1-(pyridin-4-yl)ethylidene]acetohydrazide

InChI: InChI=1S/C25H24N6O3S/c1-17(18-11-13-26-14-12-18)27-28-23(32)16-35-25-30-29-24(31(25)20-7-5-4-6-8-20)19-9-10-21(33-2)22(15-19)34-3/h4-15H,16H2,1-3H3,(H,28,32)/b27-17+

Composition: C (61.46%), H (4.95%), N (17.20%), O (9.82%), S (6.56%)

Molar Mass: 488.57

Atom Count: 59

Heavy Atom Count: 35

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	0
Exact Mass	488.163059831
Formal Charge	0
FSP3	0.16
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	1
InChIKey	IQMXZBYXIGUBCI-WPWMEQJKSA-N
Lipinski's Rule of Five	1
Molar Refractivity	157.3
Topological Polar Surface Area	103.52
Polarizability	52.89
Ring Count	4
Rotatable Bond Count	9

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C25H24N6O3S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00