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N-[(2-chlorophenyl)methyl]-2-(N-ethyl-4-methylbenzenesulfonamido)acetamide

N-[(2-chlorophenyl)methyl]-2-(N-ethyl-4-methylbenzenesulfonamido)acetamide

Formula: C18H21ClN2O3S

SMILES: CCN(CC(=O)NCC1=CC=CC=C1Cl)S(=O)(=O)C1=CC=C(C)C=C1

IUPAC: N-[(2-chlorophenyl)methyl]-2-(N-ethyl-4-methylbenzenesulfonamido)acetamide

InChI: InChI=1S/C18H21ClN2O3S/c1-3-21(25(23,24)16-10-8-14(2)9-11-16)13-18(22)20-12-15-6-4-5-7-17(15)19/h4-11H,3,12-13H2,1-2H3,(H,20,22)

Composition: C (56.76%), H (5.56%), Cl (9.31%), N (7.35%), O (12.60%), S (8.42%)

Molar Mass: 380.89

Atom Count: 46

Heavy Atom Count: 25

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 380.0961414
Formal Charge 0
FSP3 0.28
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey NFMPSHXFGHPDKR-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 100.02
Topological Polar Surface Area 66.48
Polarizability 39.26
Ring Count 2
Rotatable Bond Count 6

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Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C18H21ClN2O3S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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