2-{N-[(4-bromophenyl)methyl]-4-chlorobenzenesulfonamido}-N-ethylacetamide

2-{N-[(4-bromophenyl)methyl]-4-chlorobenzenesulfonamido}-N-ethylacetamide

Formula: C17H18BrClN2O3S

SMILES: CCNC(=O)CN(CC1=CC=C(Br)C=C1)S(=O)(=O)C1=CC=C(Cl)C=C1

IUPAC: 2-{N-[(4-bromophenyl)methyl]-4-chlorobenzenesulfonamido}-N-ethylacetamide

InChI: InChI=1S/C17H18BrClN2O3S/c1-2-20-17(22)12-21(11-13-3-5-14(18)6-4-13)25(23,24)16-9-7-15(19)8-10-16/h3-10H,2,11-12H2,1H3,(H,20,22)

Composition: C (45.81%), H (4.07%), Br (17.93%), Cl (7.95%), N (6.28%), O (10.77%), S (7.19%)

Molar Mass: 445.76

Atom Count: 43

Heavy Atom Count: 25

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	443.991004
Formal Charge	0
FSP3	0.24
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	DMYVYDXQSLKAFX-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	102.6
Topological Polar Surface Area	66.48
Polarizability	40.35
Ring Count	2
Rotatable Bond Count	6

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C17H18BrClN2O3S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00