6-[(4-chlorophenyl)methyl]-3-propyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

6-[(4-chlorophenyl)methyl]-3-propyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

Formula: C13H13ClN4S

SMILES: CCCC1=NN=C2SC(CC3=CC=C(Cl)C=C3)=NN12

IUPAC: 6-[(4-chlorophenyl)methyl]-3-propyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

InChI: InChI=1S/C13H13ClN4S/c1-2-3-11-15-16-13-18(11)17-12(19-13)8-9-4-6-10(14)7-5-9/h4-7H,2-3,8H2,1H3

Composition: C (53.33%), H (4.48%), Cl (12.11%), N (19.14%), S (10.95%)

Molar Mass: 292.79

Atom Count: 32

Heavy Atom Count: 19

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	292.0549453
Formal Charge	0
FSP3	0.31
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	AMIOBGDPNBRREI-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	99.46
Topological Polar Surface Area	43.08
Polarizability	28.93
Ring Count	3
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C13H13ClN4S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00