4-chloro-N-[3-(N-methylmethanesulfonamido)phenyl]-3-(pyrrolidine-1-sulfonyl)benzamide

4-chloro-N-[3-(N-methylmethanesulfonamido)phenyl]-3-(pyrrolidine-1-sulfonyl)benzamide

Formula: C19H22ClN3O5S2

SMILES: CN(C1=CC(NC(=O)C2=CC=C(Cl)C(=C2)S(=O)(=O)N2CCCC2)=CC=C1)S(C)(=O)=O

IUPAC: 4-chloro-N-[3-(N-methylmethanesulfonamido)phenyl]-3-(pyrrolidine-1-sulfonyl)benzamide

InChI: InChI=1S/C19H22ClN3O5S2/c1-22(29(2,25)26)16-7-5-6-15(13-16)21-19(24)14-8-9-17(20)18(12-14)30(27,28)23-10-3-4-11-23/h5-9,12-13H,3-4,10-11H2,1-2H3,(H,21,24)

Composition: C (48.35%), H (4.70%), Cl (7.51%), N (8.90%), O (16.95%), S (13.59%)

Molar Mass: 471.97

Atom Count: 52

Heavy Atom Count: 30

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	471.0689409
Formal Charge	0
FSP3	0.32
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
InChIKey	RMMUYPPYTYZSBH-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	117.47
Topological Polar Surface Area	103.86
Polarizability	45.85
Ring Count	3
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C19H22ClN3O5S2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00