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N-(2H-1,3-benzodioxol-5-yl)-2-(N-ethyl-4-ethoxy-3-methylbenzenesulfonamido)acetamide

N-(2H-1,3-benzodioxol-5-yl)-2-(N-ethyl-4-ethoxy-3-methylbenzenesulfonamido)acetamide

Formula: C20H24N2O6S

SMILES: CCOC1=CC=C(C=C1C)S(=O)(=O)N(CC)CC(=O)NC1=CC=C2OCOC2=C1

IUPAC: N-(2H-1,3-benzodioxol-5-yl)-2-(N-ethyl-4-ethoxy-3-methylbenzenesulfonamido)acetamide

InChI: InChI=1S/C20H24N2O6S/c1-4-22(29(24,25)16-7-9-17(26-5-2)14(3)10-16)12-20(23)21-15-6-8-18-19(11-15)28-13-27-18/h6-11H,4-5,12-13H2,1-3H3,(H,21,23)

Composition: C (57.13%), H (5.75%), N (6.66%), O (22.83%), S (7.62%)

Molar Mass: 420.48

Atom Count: 53

Heavy Atom Count: 29

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 420.135507675
Formal Charge 0
FSP3 0.35
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 6
Hydrogen Bond Donor Count 1
InChIKey VUEZFLYRJCIGSD-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 109.14
Topological Polar Surface Area 94.17
Polarizability 42.41
Ring Count 3
Rotatable Bond Count 7

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C20H24N2O6S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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