4-methanesulfonamido-N-(4-{[3-(trifluoromethyl)phenyl]sulfamoyl}phenyl)benzamide

4-methanesulfonamido-N-(4-{[3-(trifluoromethyl)phenyl]sulfamoyl}phenyl)benzamide

Formula: C21H18F3N3O5S2

SMILES: CS(=O)(=O)NC1=CC=C(C=C1)C(=O)NC1=CC=C(C=C1)S(=O)(=O)NC1=CC=CC(=C1)C(F)(F)F

IUPAC: 4-methanesulfonamido-N-(4-{[3-(trifluoromethyl)phenyl]sulfamoyl}phenyl)benzamide

InChI: InChI=1S/C21H18F3N3O5S2/c1-33(29,30)26-17-7-5-14(6-8-17)20(28)25-16-9-11-19(12-10-16)34(31,32)27-18-4-2-3-15(13-18)21(22,23)24/h2-13,26-27H,1H3,(H,25,28)

Composition: C (49.12%), H (3.53%), F (11.10%), N (8.18%), O (15.58%), S (12.49%)

Molar Mass: 513.51

Atom Count: 52

Heavy Atom Count: 34

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	513.063997529
Formal Charge	0
FSP3	0.1
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	3
InChIKey	PEKUEKYVOFCPSX-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	121.08
Topological Polar Surface Area	121.44
Polarizability	46.17
Ring Count	3
Rotatable Bond Count	6

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C21H18F3N3O5S2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00