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3-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-1-(2-ethylphenyl)pyrrolidine-2,5-dione

3-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-1-(2-ethylphenyl)pyrrolidine-2,5-dione

Formula: C18H19N3O2S

SMILES: CCC1=CC=CC=C1N1C(=O)CC(SC2=NC(C)=CC(C)=N2)C1=O

IUPAC: 3-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-1-(2-ethylphenyl)pyrrolidine-2,5-dione

InChI: InChI=1/C18H19N3O2S/c1-4-13-7-5-6-8-14(13)21-16(22)10-15(17(21)23)24-18-19-11(2)9-12(3)20-18/h5-9,15H,4,10H2,1-3H3

Composition: C (63.32%), H (5.61%), N (12.31%), O (9.37%), S (9.39%)

Molar Mass: 341.43

Atom Count: 43

Heavy Atom Count: 24

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 1
Exact Mass 341.119798038
Formal Charge 0
FSP3 0.33
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 0
InChIKey RVGVZSLHOYVVAW-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 94.43
Topological Polar Surface Area 63.16
Polarizability 36.25
Ring Count 3
Rotatable Bond Count 4

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Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C18H19N3O2S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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