4-(4-chloro-2-methylphenoxy)-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]butanamide

4-(4-chloro-2-methylphenoxy)-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]butanamide

Formula: C14H13ClF3N3O2S

SMILES: CC1=CC(Cl)=CC=C1OCCCC(=O)NC1=NN=C(S1)C(F)(F)F

IUPAC: 4-(4-chloro-2-methylphenoxy)-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]butanamide

InChI: InChI=1S/C14H13ClF3N3O2S/c1-8-7-9(15)4-5-10(8)23-6-2-3-11(22)19-13-21-20-12(24-13)14(16,17)18/h4-5,7H,2-3,6H2,1H3,(H,19,21,22)

Composition: C (44.28%), H (3.45%), Cl (9.33%), F (15.01%), N (11.06%), O (8.43%), S (8.44%)

Molar Mass: 379.78

Atom Count: 37

Heavy Atom Count: 24

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	379.03691
Formal Charge	0
FSP3	0.36
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	NCENFGUJCFGARV-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	86.44
Topological Polar Surface Area	64.11
Polarizability	31.17
Ring Count	2
Rotatable Bond Count	7

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C14H13ClF3N3O2S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00