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N-[(4-methylphenyl)methyl]-N-[4-(4-phenylpiperazine-1-carbonyl)phenyl]methanesulfonamide

N-[(4-methylphenyl)methyl]-N-[4-(4-phenylpiperazine-1-carbonyl)phenyl]methanesulfonamide

Formula: C26H29N3O3S

SMILES: CC1=CC=C(CN(C2=CC=C(C=C2)C(=O)N2CCN(CC2)C2=CC=CC=C2)S(C)(=O)=O)C=C1

IUPAC: N-[(4-methylphenyl)methyl]-N-[4-(4-phenylpiperazine-1-carbonyl)phenyl]methanesulfonamide

InChI: InChI=1S/C26H29N3O3S/c1-21-8-10-22(11-9-21)20-29(33(2,31)32)25-14-12-23(13-15-25)26(30)28-18-16-27(17-19-28)24-6-4-3-5-7-24/h3-15H,16-20H2,1-2H3

Composition: C (67.36%), H (6.31%), N (9.06%), O (10.35%), S (6.92%)

Molar Mass: 463.6

Atom Count: 62

Heavy Atom Count: 33

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 463.19296298
Formal Charge 0
FSP3 0.27
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 0
InChIKey PDXVAMDEOREIMO-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 132.71
Topological Polar Surface Area 60.93
Polarizability 50.87
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 C26H29N3O3S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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