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

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

Formula: C17H14Cl2N4O2S

SMILES: COC1=CC=CC=C1NC(=O)CSC1=NNC(=N1)C1=CC=C(Cl)C=C1Cl

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

InChI: InChI=1S/C17H14Cl2N4O2S/c1-25-14-5-3-2-4-13(14)20-15(24)9-26-17-21-16(22-23-17)11-7-6-10(18)8-12(11)19/h2-8H,9H2,1H3,(H,20,24)(H,21,22,23)

Composition: C (49.89%), H (3.45%), Cl (17.32%), N (13.69%), O (7.82%), S (7.83%)

Molar Mass: 409.29

Atom Count: 40

Heavy Atom Count: 26

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	408.0214523
Formal Charge	0
FSP3	0.12
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
InChIKey	COFAIRBCEKVNAX-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	117.31
Topological Polar Surface Area	79.9
Polarizability	40.4
Ring Count	3
Rotatable Bond Count	6

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C17H14Cl2N4O2S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00