2-{2-[N-(4-ethoxyphenyl)methanesulfonamido]acetamido}benzoic acid

2-{2-[N-(4-ethoxyphenyl)methanesulfonamido]acetamido}benzoic acid

Formula: C18H20N2O6S

SMILES: CCOC1=CC=C(C=C1)N(CC(=O)NC1=CC=CC=C1C(O)=O)S(C)(=O)=O

IUPAC: 2-{2-[N-(4-ethoxyphenyl)methanesulfonamido]acetamido}benzoic acid

InChI: InChI=1S/C18H20N2O6S/c1-3-26-14-10-8-13(9-11-14)20(27(2,24)25)12-17(21)19-16-7-5-4-6-15(16)18(22)23/h4-11H,3,12H2,1-2H3,(H,19,21)(H,22,23)

Composition: C (55.09%), H (5.14%), N (7.14%), O (24.46%), S (8.17%)

Molar Mass: 392.43

Atom Count: 47

Heavy Atom Count: 27

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	392.104207546
Formal Charge	0
FSP3	0.22
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	2
InChIKey	HIJCPLBSEOVKDY-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	100.47
Topological Polar Surface Area	113.01
Polarizability	38.72
Ring Count	2
Rotatable Bond Count	7

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C18H20N2O6S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00