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N-[4-(4-phenylmethanesulfonylpiperazin-1-ylsulfonyl)phenyl]acetamide

N-[4-(4-phenylmethanesulfonylpiperazin-1-ylsulfonyl)phenyl]acetamide

Formula: C19H23N3O5S2

SMILES: CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N1CCN(CC1)S(=O)(=O)CC1=CC=CC=C1

IUPAC: N-{4-[(4-phenylmethanesulfonylpiperazin-1-yl)sulfonyl]phenyl}acetamide

InChI: InChI=1S/C19H23N3O5S2/c1-16(23)20-18-7-9-19(10-8-18)29(26,27)22-13-11-21(12-14-22)28(24,25)15-17-5-3-2-4-6-17/h2-10H,11-15H2,1H3,(H,20,23)

Composition: C (52.16%), H (5.30%), N (9.60%), O (18.28%), S (14.66%)

Molar Mass: 437.53

Atom Count: 52

Heavy Atom Count: 29

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 437.107913201
Formal Charge 0
FSP3 0.32
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 1
InChIKey PGRSUTFVEHUGNS-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 111.53
Topological Polar Surface Area 103.86
Polarizability 43.93
Ring Count 3
Rotatable Bond Count 4

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C19H23N3O5S2 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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