2-({5-[(4-methoxyphenyl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide

2-({5-[(4-methoxyphenyl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide

Formula: C16H17N5O2S2

SMILES: COC1=CC=C(CC2=NN=C(N2)SCC(=O)NC2=NC(C)=CS2)C=C1

IUPAC: 2-({5-[(4-methoxyphenyl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide

InChI: InChI=1S/C16H17N5O2S2/c1-10-8-24-15(17-10)19-14(22)9-25-16-18-13(20-21-16)7-11-3-5-12(23-2)6-4-11/h3-6,8H,7,9H2,1-2H3,(H,17,19,22)(H,18,20,21)

Composition: C (51.18%), H (4.56%), N (18.65%), O (8.52%), S (17.08%)

Molar Mass: 375.47

Atom Count: 42

Heavy Atom Count: 25

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	375.082367155
Formal Charge	0
FSP3	0.25
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
InChIKey	JBCYXJNKTZUYCR-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	100.87
Topological Polar Surface Area	92.79
Polarizability	37.29
Ring Count	3
Rotatable Bond Count	7

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C16H17N5O2S2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00