N-{2-[(4-chlorophenyl)sulfanyl]ethyl}-2-[N-(4-ethoxyphenyl)methanesulfonamido]propanamide

N-{2-[(4-chlorophenyl)sulfanyl]ethyl}-2-[N-(4-ethoxyphenyl)methanesulfonamido]propanamide

Formula: C20H25ClN2O4S2

SMILES: CCOC1=CC=C(C=C1)N(C(C)C(=O)NCCSC1=CC=C(Cl)C=C1)S(C)(=O)=O

IUPAC: N-{2-[(4-chlorophenyl)sulfanyl]ethyl}-2-[N-(4-ethoxyphenyl)methanesulfonamido]propanamide

InChI: InChI=1/C20H25ClN2O4S2/c1-4-27-18-9-7-17(8-10-18)23(29(3,25)26)15(2)20(24)22-13-14-28-19-11-5-16(21)6-12-19/h5-12,15H,4,13-14H2,1-3H3,(H,22,24)

Composition: C (52.56%), H (5.51%), Cl (7.76%), N (6.13%), O (14.00%), S (14.03%)

Molar Mass: 457

Atom Count: 54

Heavy Atom Count: 29

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	1
Exact Mass	456.0944273
Formal Charge	0
FSP3	0.35
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	SMNHDMUMYYOVOG-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	118
Topological Polar Surface Area	75.71
Polarizability	46.78
Ring Count	2
Rotatable Bond Count	9

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C20H25ClN2O4S2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00