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1-(3-chlorobenzoyl)-4-(naphthalene-2-sulfonyl)piperazine

1-(3-chlorobenzoyl)-4-(naphthalene-2-sulfonyl)piperazine

Formula: C21H19ClN2O3S

SMILES: ClC1=CC=CC(=C1)C(=O)N1CCN(CC1)S(=O)(=O)C1=CC2=CC=CC=C2C=C1

IUPAC: 1-(3-chlorobenzoyl)-4-(naphthalene-2-sulfonyl)piperazine

InChI: InChI=1S/C21H19ClN2O3S/c22-19-7-3-6-18(14-19)21(25)23-10-12-24(13-11-23)28(26,27)20-9-8-16-4-1-2-5-17(16)15-20/h1-9,14-15H,10-13H2

Composition: C (60.79%), H (4.62%), Cl (8.54%), N (6.75%), O (11.57%), S (7.73%)

Molar Mass: 414.9

Atom Count: 47

Heavy Atom Count: 28

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 414.0804914
Formal Charge 0
FSP3 0.19
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey MFXXUDKCXYJLPO-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 110.26
Topological Polar Surface Area 57.69
Polarizability 44.03
Ring Count 4
Rotatable Bond Count 2

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Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C21H19ClN2O3S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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