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2-oxo-2-(thiophen-2-yl)ethyl 1-(4-chlorobenzamido)-5-oxopyrrolidine-3-carboxylate

2-oxo-2-(thiophen-2-yl)ethyl 1-(4-chlorobenzamido)-5-oxopyrrolidine-3-carboxylate

Formula: C18H15ClN2O5S

SMILES: ClC1=CC=C(C=C1)C(=O)NN1CC(CC1=O)C(=O)OCC(=O)C1=CC=CS1

IUPAC: 2-oxo-2-(thiophen-2-yl)ethyl 1-(4-chlorobenzamido)-5-oxopyrrolidine-3-carboxylate

InChI: InChI=1/C18H15ClN2O5S/c19-13-5-3-11(4-6-13)17(24)20-21-9-12(8-16(21)23)18(25)26-10-14(22)15-2-1-7-27-15/h1-7,12H,8-10H2,(H,20,24)

Composition: C (53.14%), H (3.72%), Cl (8.71%), N (6.89%), O (19.66%), S (7.88%)

Molar Mass: 406.84

Atom Count: 42

Heavy Atom Count: 27

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 1
Exact Mass 406.0390205
Formal Charge 0
FSP3 0.22
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey IJAOMHOYUCDMLJ-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 98.25
Topological Polar Surface Area 92.78
Polarizability 37.68
Ring Count 3
Rotatable Bond Count 7

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Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C18H15ClN2O5S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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