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name Structure Reference Source Properties Activities Metabolism

(3R,3'S,5'R)-N-(2,5-dimethoxyphenyl)-5-fluoro-5'-[(1R)-1-hydroxyethyl]-2-oxo-1H-spiro[indole-3,2'-pyrrolidine]-3'-carboxamide

AlkaPlorer ID: AK545491

Synonym: None

IUPAC Name: (3R,3'S,5'R)-N-(2,5-dimethoxyphenyl)-5-fluoro-5'-[(1R)-1-hydroxyethyl]-2-oxospiro[1H-indole-3,2'-pyrrolidine]-3'-carboxamide

Structure

SMILES: COC1=CC=C(OC)C(NC(=O)[C@H]2C[C@H]([C@@H](C)O)N[C@]23C(=O)NC2=CC=C(F)C=C23)=C1

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InChI: InChI=1S/C22H24FN3O5/c1-11(27)17-10-15(20(28)24-18-9-13(30-2)5-7-19(18)31-3)22(26-17)14-8-12(23)4-6-16(14)25-21(22)29/h4-9,11,15,17,26-27H,10H2,1-3H3,(H,24,28)(H,25,29)/t11-,15-,17-,22+/m1/s1

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InChIKey: VDTPQSMPHAKDCF-IRQJKIPJSA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain

Properties Information

Molecule Weight: 429.4480000000001

TPSA？: 108.92000000000002

MolLogP？: 1.9879

Number of H-Donors: 4

Number of H-Acceptors: 6

RingCount: 4

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information