4-tert-butyl-N-[5-(2,4-dichlorophenyl)-1,3,4-thiadiazol-2-yl]benzamide

4-tert-butyl-N-[5-(2,4-dichlorophenyl)-1,3,4-thiadiazol-2-yl]benzamide

Formula: C19H17Cl2N3OS

SMILES: CC(C)(C)C1=CC=C(C=C1)C(=O)NC1=NN=C(S1)C1=CC=C(Cl)C=C1Cl

IUPAC: 4-tert-butyl-N-[5-(2,4-dichlorophenyl)-1,3,4-thiadiazol-2-yl]benzamide

InChI: InChI=1S/C19H17Cl2N3OS/c1-19(2,3)12-6-4-11(5-7-12)16(25)22-18-24-23-17(26-18)14-9-8-13(20)10-15(14)21/h4-10H,1-3H3,(H,22,24,25)

Composition: C (56.16%), H (4.22%), Cl (17.45%), N (10.34%), O (3.94%), S (7.89%)

Molar Mass: 406.33

Atom Count: 43

Heavy Atom Count: 26

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	405.0469388
Formal Charge	0
FSP3	0.21
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	CSWJOINLJZVSCC-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	119.77
Topological Polar Surface Area	54.88
Polarizability	41.21
Ring Count	3
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C19H17Cl2N3OS		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00