1-(3,4-dichlorophenyl)-3-[5-(2-fluorophenoxymethyl)-1,3,4-thiadiazol-2-yl]urea

1-(3,4-dichlorophenyl)-3-[5-(2-fluorophenoxymethyl)-1,3,4-thiadiazol-2-yl]urea

Formula: C16H11Cl2FN4O2S

SMILES: FC1=CC=CC=C1OCC1=NN=C(NC(=O)NC2=CC=C(Cl)C(Cl)=C2)S1

IUPAC: 1-(3,4-dichlorophenyl)-3-{5-[(2-fluorophenoxy)methyl]-1,3,4-thiadiazol-2-yl}urea

InChI: InChI=1S/C16H11Cl2FN4O2S/c17-10-6-5-9(7-11(10)18)20-15(24)21-16-23-22-14(26-16)8-25-13-4-2-1-3-12(13)19/h1-7H,8H2,(H2,20,21,23,24)

Composition: C (46.50%), H (2.68%), Cl (17.16%), F (4.60%), N (13.56%), O (7.74%), S (7.76%)

Molar Mass: 413.25

Atom Count: 37

Heavy Atom Count: 26

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	411.9963803
Formal Charge	0
FSP3	0.06
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
InChIKey	CTRWZLFXZRMQSV-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	101.09
Topological Polar Surface Area	76.14
Polarizability	36.8
Ring Count	3
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C16H11Cl2FN4O2S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00