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1-(4-chlorobenzenesulfonyl)-4-(3,4-dimethoxybenzoyl)piperazine

1-(4-chlorobenzenesulfonyl)-4-(3,4-dimethoxybenzoyl)piperazine

Formula: C19H21ClN2O5S

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

IUPAC: 1-(4-chlorobenzenesulfonyl)-4-(3,4-dimethoxybenzoyl)piperazine

InChI: InChI=1S/C19H21ClN2O5S/c1-26-17-8-3-14(13-18(17)27-2)19(23)21-9-11-22(12-10-21)28(24,25)16-6-4-15(20)5-7-16/h3-8,13H,9-12H2,1-2H3

Composition: C (53.71%), H (4.98%), Cl (8.34%), N (6.59%), O (18.83%), S (7.55%)

Molar Mass: 424.9

Atom Count: 49

Heavy Atom Count: 28

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 424.0859707
Formal Charge 0
FSP3 0.32
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 0
InChIKey YXAZCJDDQGNVBG-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 106.73
Topological Polar Surface Area 76.15
Polarizability 41.67
Ring Count 3
Rotatable Bond Count 4

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Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C19H21ClN2O5S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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