2-phenyl-N-(2,2,2-trichloro-1-{[(4-ethoxyphenyl)carbamothioyl]amino}ethyl)acetamide

2-phenyl-N-(2,2,2-trichloro-1-{[(4-ethoxyphenyl)carbamothioyl]amino}ethyl)acetamide

Formula: C19H20Cl3N3O2S

SMILES: CCOC1=CC=C(NC(=S)NC(NC(=O)CC2=CC=CC=C2)C(Cl)(Cl)Cl)C=C1

IUPAC: 2-phenyl-N-(2,2,2-trichloro-1-{[(4-ethoxyphenyl)carbamothioyl]amino}ethyl)acetamide

InChI: InChI=1/C19H20Cl3N3O2S/c1-2-27-15-10-8-14(9-11-15)23-18(28)25-17(19(20,21)22)24-16(26)12-13-6-4-3-5-7-13/h3-11,17H,2,12H2,1H3,(H,24,26)(H2,23,25,28)

Composition: C (49.52%), H (4.38%), Cl (23.08%), N (9.12%), O (6.94%), S (6.96%)

Molar Mass: 460.8

Atom Count: 48

Heavy Atom Count: 28

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	1
Exact Mass	459.0341812
Formal Charge	0
FSP3	0.26
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	3
InChIKey	PZUINKUJNDVCSO-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	120.5
Topological Polar Surface Area	62.39
Polarizability	45.94
Ring Count	2
Rotatable Bond Count	8

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C19H20Cl3N3O2S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00