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1-(benzenesulfonyl)-4-(3,4,5-trimethoxybenzoyl)piperazine

1-(benzenesulfonyl)-4-(3,4,5-trimethoxybenzoyl)piperazine

Formula: C20H24N2O6S

SMILES: COC1=CC(=CC(OC)=C1OC)C(=O)N1CCN(CC1)S(=O)(=O)C1=CC=CC=C1

IUPAC: 1-(benzenesulfonyl)-4-(3,4,5-trimethoxybenzoyl)piperazine

InChI: InChI=1S/C20H24N2O6S/c1-26-17-13-15(14-18(27-2)19(17)28-3)20(23)21-9-11-22(12-10-21)29(24,25)16-7-5-4-6-8-16/h4-8,13-14H,9-12H2,1-3H3

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 0
InChIKey GGBIZFAFMJRBHP-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 108.39
Topological Polar Surface Area 85.38
Polarizability 42.29
Ring Count 3
Rotatable Bond Count 5

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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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