ethyl 2-benzenesulfonamido-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

ethyl 2-benzenesulfonamido-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Formula: C17H19NO4S2

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

IUPAC: ethyl 2-benzenesulfonamido-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

InChI: InChI=1S/C17H19NO4S2/c1-2-22-17(19)15-13-10-6-7-11-14(13)23-16(15)18-24(20,21)12-8-4-3-5-9-12/h3-5,8-9,18H,2,6-7,10-11H2,1H3

Composition: C (55.87%), H (5.24%), N (3.83%), O (17.51%), S (17.54%)

Molar Mass: 365.46

Atom Count: 43

Heavy Atom Count: 24

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	365.075550444
Formal Charge	0
FSP3	0.35
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	CBQRZBXNKYYYEB-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	93.35
Topological Polar Surface Area	72.47
Polarizability	36.65
Ring Count	3
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C17H19NO4S2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00