ethyl 2-(3,4-dimethoxybenzenesulfonamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

ethyl 2-(3,4-dimethoxybenzenesulfonamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Formula: C19H23NO6S2

SMILES: CCOC(=O)C1=C(NS(=O)(=O)C2=CC=C(OC)C(OC)=C2)SC2=C1CCCC2

IUPAC: ethyl 2-(3,4-dimethoxybenzenesulfonamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

InChI: InChI=1S/C19H23NO6S2/c1-4-26-19(21)17-13-7-5-6-8-16(13)27-18(17)20-28(22,23)12-9-10-14(24-2)15(11-12)25-3/h9-11,20H,4-8H2,1-3H3

Composition: C (53.63%), H (5.45%), N (3.29%), O (22.56%), S (15.07%)

Molar Mass: 425.51

Atom Count: 51

Heavy Atom Count: 28

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	425.096679813
Formal Charge	0
FSP3	0.42
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
InChIKey	ZNLPSZCGVVWDMT-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	106.28
Topological Polar Surface Area	90.93
Polarizability	41.75
Ring Count	3
Rotatable Bond Count	7

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C19H23NO6S2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00