3-[5-(4-ethylphenoxymethyl)-1,3,4-thiadiazol-2-yl]-1-(2-methoxyphenyl)urea

3-[5-(4-ethylphenoxymethyl)-1,3,4-thiadiazol-2-yl]-1-(2-methoxyphenyl)urea

Formula: C19H20N4O3S

SMILES: CCC1=CC=C(OCC2=NN=C(NC(=O)NC3=CC=CC=C3OC)S2)C=C1

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

InChI: InChI=1S/C19H20N4O3S/c1-3-13-8-10-14(11-9-13)26-12-17-22-23-19(27-17)21-18(24)20-15-6-4-5-7-16(15)25-2/h4-11H,3,12H2,1-2H3,(H2,20,21,23,24)

Composition: C (59.36%), H (5.24%), N (14.57%), O (12.48%), S (8.34%)

Molar Mass: 384.45

Atom Count: 47

Heavy Atom Count: 27

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	384.125611694
Formal Charge	0
FSP3	0.21
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
InChIKey	VBANAEUAHPKJRB-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	107.37
Topological Polar Surface Area	85.37
Polarizability	39.28
Ring Count	3
Rotatable Bond Count	7

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C19H20N4O3S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00