3-phenyl-1-{4-[(4-sulfamoylphenyl)sulfamoyl]phenyl}thiourea

3-phenyl-1-{4-[(4-sulfamoylphenyl)sulfamoyl]phenyl}thiourea

Formula: C19H18N4O4S3

SMILES: NS(=O)(=O)C1=CC=C(NS(=O)(=O)C2=CC=C(NC(=S)NC3=CC=CC=C3)C=C2)C=C1

IUPAC: 3-phenyl-1-{4-[(4-sulfamoylphenyl)sulfamoyl]phenyl}thiourea

InChI: InChI=1S/C19H18N4O4S3/c20-29(24,25)17-10-8-16(9-11-17)23-30(26,27)18-12-6-15(7-13-18)22-19(28)21-14-4-2-1-3-5-14/h1-13,23H,(H2,20,24,25)(H2,21,22,28)

Composition: C (49.34%), H (3.92%), N (12.11%), O (13.84%), S (20.79%)

Molar Mass: 462.56

Atom Count: 48

Heavy Atom Count: 30

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	462.049018598
Formal Charge	0
FSP3	0
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	4
InChIKey	WGCSVSJKBKYKJN-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	123.03
Topological Polar Surface Area	130.39
Polarizability	47.61
Ring Count	3
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C19H18N4O4S3		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00