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N-{4-[4-(4-benzylpiperazin-1-yl)piperidin-1-ylsulfonyl]phenyl}acetamide

N-{4-[4-(4-benzylpiperazin-1-yl)piperidin-1-ylsulfonyl]phenyl}acetamide

Formula: C24H32N4O3S

SMILES: CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N1CCC(CC1)N1CCN(CC2=CC=CC=C2)CC1

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

InChI: InChI=1S/C24H32N4O3S/c1-20(29)25-22-7-9-24(10-8-22)32(30,31)28-13-11-23(12-14-28)27-17-15-26(16-18-27)19-21-5-3-2-4-6-21/h2-10,23H,11-19H2,1H3,(H,25,29)

Composition: C (63.13%), H (7.06%), N (12.27%), O (10.51%), S (7.02%)

Molar Mass: 456.61

Atom Count: 64

Heavy Atom Count: 32

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 456.21951208
Formal Charge 0
FSP3 0.46
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 1
InChIKey USDMRKREVOCWBY-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 128.99
Topological Polar Surface Area 72.96
Polarizability 50.08
Ring Count 4
Rotatable Bond Count 5

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C24H32N4O3S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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