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N-(4-chlorophenyl)-2-{[2,5-dioxo-1-(4-propoxyphenyl)pyrrolidin-3-yl]sulfanyl}acetamide

N-(4-chlorophenyl)-2-{[2,5-dioxo-1-(4-propoxyphenyl)pyrrolidin-3-yl]sulfanyl}acetamide

Formula: C21H21ClN2O4S

SMILES: CCCOC1=CC=C(C=C1)N1C(=O)CC(SCC(=O)NC2=CC=C(Cl)C=C2)C1=O

IUPAC: N-(4-chlorophenyl)-2-{[2,5-dioxo-1-(4-propoxyphenyl)pyrrolidin-3-yl]sulfanyl}acetamide

InChI: InChI=1/C21H21ClN2O4S/c1-2-11-28-17-9-7-16(8-10-17)24-20(26)12-18(21(24)27)29-13-19(25)23-15-5-3-14(22)4-6-15/h3-10,18H,2,11-13H2,1H3,(H,23,25)

Composition: C (58.26%), H (4.89%), Cl (8.19%), N (6.47%), O (14.78%), S (7.41%)

Molar Mass: 432.92

Atom Count: 50

Heavy Atom Count: 29

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 1
Exact Mass 432.091056
Formal Charge 0
FSP3 0.29
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey GOIDYQQMPNRTLO-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 114.12
Topological Polar Surface Area 75.71
Polarizability 43.87
Ring Count 3
Rotatable Bond Count 8

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Purity (%)
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Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C21H21ClN2O4S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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