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

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

Formula: C14H17ClN4OS

SMILES: CC(C)CC1=NN=C(N1)SCC(=O)NC1=CC=CC=C1Cl

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

InChI: InChI=1S/C14H17ClN4OS/c1-9(2)7-12-17-14(19-18-12)21-8-13(20)16-11-6-4-3-5-10(11)15/h3-6,9H,7-8H2,1-2H3,(H,16,20)(H,17,18,19)

Composition: C (51.77%), H (5.28%), Cl (10.91%), N (17.25%), O (4.93%), S (9.87%)

Molar Mass: 324.83

Atom Count: 38

Heavy Atom Count: 21

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	324.0811601
Formal Charge	0
FSP3	0.36
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	CUDNVQRTJCRBOU-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	88.99
Topological Polar Surface Area	70.67
Polarizability	33
Ring Count	2
Rotatable Bond Count	6

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C14H17ClN4OS		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00