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

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

Formula: C32H31N5OS

SMILES: CC(=N/NC(=O)CSC1=NN=C(N1C1=CC=CC=C1)C1=CC=C(C=C1)C(C)(C)C)C1=CC2=CC=CC=C2C=C1

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

InChI: InChI=1S/C32H31N5OS/c1-22(25-15-14-23-10-8-9-11-26(23)20-25)33-34-29(38)21-39-31-36-35-30(37(31)28-12-6-5-7-13-28)24-16-18-27(19-17-24)32(2,3)4/h5-20H,21H2,1-4H3,(H,34,38)/b33-22+

Composition: C (72.02%), H (5.86%), N (13.12%), O (3.00%), S (6.01%)

Molar Mass: 533.69

Atom Count: 70

Heavy Atom Count: 39

Properties

Properties

Common Names	N/A
Aromatic Ring Count	5
Asymmetric Atom Count	0
Exact Mass	533.224931812
Formal Charge	0
FSP3	0.19
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	SYGDESGKIHIJKM-STKMKYKTSA-N
Lipinski's Rule of Five
Molar Refractivity	181.64
Topological Polar Surface Area	72.17
Polarizability	63.66
Ring Count	5
Rotatable Bond Count	8

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C32H31N5OS		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00