2-[(5-butyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(pyrimidin-2-yl)acetamide

2-[(5-butyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(pyrimidin-2-yl)acetamide

Formula: C12H16N6OS

SMILES: CCCCC1=NN=C(N1)SCC(=O)NC1=NC=CC=N1

IUPAC: 2-[(5-butyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(pyrimidin-2-yl)acetamide

InChI: InChI=1S/C12H16N6OS/c1-2-3-5-9-15-12(18-17-9)20-8-10(19)16-11-13-6-4-7-14-11/h4,6-7H,2-3,5,8H2,1H3,(H,15,17,18)(H,13,14,16,19)

Composition: C (49.30%), H (5.52%), N (28.75%), O (5.47%), S (10.97%)

Molar Mass: 292.36

Atom Count: 36

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	292.110630333
Formal Charge	0
FSP3	0.42
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
InChIKey	MUNZOSQRJHMWSO-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	80.85
Topological Polar Surface Area	96.45
Polarizability	29.36
Ring Count	2
Rotatable Bond Count	7

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C12H16N6OS		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00