N'-[(E)-{3-bromo-4-[2-(4-tert-butylphenoxy)ethoxy]-5-methoxyphenyl}methylidene]-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetohydrazide

N'-[(E)-{3-bromo-4-[2-(4-tert-butylphenoxy)ethoxy]-5-methoxyphenyl}methylidene]-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetohydrazide

Formula: C25H29BrN4O4S2

SMILES: COC1=CC(C=NNC(=O)CSC2=NN=C(C)S2)=CC(Br)=C1OCCOC1=CC=C(C=C1)C(C)(C)C

IUPAC: N'-[(E)-{3-bromo-4-[2-(4-tert-butylphenoxy)ethoxy]-5-methoxyphenyl}methylidene]-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetohydrazide

InChI: InChI=1S/C25H29BrN4O4S2/c1-16-28-30-24(36-16)35-15-22(31)29-27-14-17-12-20(26)23(21(13-17)32-5)34-11-10-33-19-8-6-18(7-9-19)25(2,3)4/h6-9,12-14H,10-11,15H2,1-5H3,(H,29,31)/b27-14+

Composition: C (50.59%), H (4.92%), Br (13.46%), N (9.44%), O (10.78%), S (10.80%)

Molar Mass: 593.56

Atom Count: 65

Heavy Atom Count: 36

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	592.081361
Formal Charge	0
FSP3	0.36
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	1
InChIKey	QETCPMFNPKEOGR-MZJWZYIUSA-N
Lipinski's Rule of Five
Molar Refractivity	148.98
Topological Polar Surface Area	94.93
Polarizability	56.41
Ring Count	3
Rotatable Bond Count	12

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C25H29BrN4O4S2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00