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N-(4-chlorophenyl)-2-[N-(4-phenoxyphenyl)methanesulfonamido]propanamide

N-(4-chlorophenyl)-2-[N-(4-phenoxyphenyl)methanesulfonamido]propanamide

Formula: C22H21ClN2O4S

SMILES: CC(N(C1=CC=C(OC2=CC=CC=C2)C=C1)S(C)(=O)=O)C(=O)NC1=CC=C(Cl)C=C1

IUPAC: N-(4-chlorophenyl)-2-[N-(4-phenoxyphenyl)methanesulfonamido]propanamide

InChI: InChI=1/C22H21ClN2O4S/c1-16(22(26)24-18-10-8-17(23)9-11-18)25(30(2,27)28)19-12-14-21(15-13-19)29-20-6-4-3-5-7-20/h3-16H,1-2H3,(H,24,26)

Composition: C (59.39%), H (4.76%), Cl (7.97%), N (6.30%), O (14.38%), S (7.21%)

Molar Mass: 444.93

Atom Count: 51

Heavy Atom Count: 30

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 1
Exact Mass 444.091056
Formal Charge 0
FSP3 0.14
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey MKJBBPJGUOMKPU-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 117.54
Topological Polar Surface Area 75.71
Polarizability 45.99
Ring Count 3
Rotatable Bond Count 6

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Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C22H21ClN2O4S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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