K 2604
Basic information
- CAS
14166-29-1- Standard SMILES
O=C1CCC(N2C(=O)[C@@H]3[C@H](C2=O)[C@H]2CC[C@@H]3O2)C(=O)N1- InChIKey
HEGYGRPHQUGLAX-GXPKTZLTSA-N- Molecular formula
- C13H14N2O5
- Average molar mass
- 278.26 g/mol
- Monoisotopic mass
- 278.09027155
Overview
structure
Names & identifiers
- Preferred name
- K 2604
- IUPAC
- (3aS,4R,7S,7aR)-2-(2,6-dioxopiperidin-3-yl)-3a,4,5,6,7,7a-hexahydro-4,7-epoxyisoindole-1,3-dione
Names & synonyms
14166-29-1K 2604TCQ0V2ZG5CK-26044,7-Epoxy-1H-isoindole-1,3(2H)-dione, 2-(2,6-dioxo-3-piperidinyl)-3a,4,5,6,7,7a-hexahydro-, (3aalpha,4beta,7beta,7aalpha)-RefChem:1507144,7-epoxy-1H-isoindole-1,3(2H)-dione, 2-(2,6-dioxo-3-piperidinyl)-3a,4,5,6,7,7a-hexahydro-, (3a alpha,4 beta,7 beta,7a alpha)-2-(7-Oxabicyclo(2.2.1)heptane-2-exo,3-exo-dicarboximido)glutarimide4,7-Epoxy-1H-isoindole-1,3(2H)-dione,2-(2,6-dioxo-3-piperidinyl)hexahydro-, (3aR,4S,7R,7aS)-rel-UNII-TCQ0V2ZG5Corb16968053-(1,4-endo-Oxocyclohexane-2,3-exo,exo-dicarboximido)piperidine-2,6-dione
Show more names
AKOS040752224NCGC01450400-014,7-Epoxy-1H-isoindole-1,3(2H)-dione, 2-(2,6-dioxo-3-piperidinyl)hexahydro-, (3a.alpha.,4.beta.,7.beta.,7a.alpha.)-T32349Z3213824439(3Ar,4S,7R,7aS)-2-(2,6-dioxopiperidin-3-yl)-3a,4,5,6,7,7a-hexahydro-4,7-epoxyisoindole-1,3-dione(3aS,4R,7S,7aR)-2-(2,6-dioxopiperidin-3-yl)-3a,4,5,6,7,7a-hexahydro-4,7-epoxyisoindole-1,3-dione4,7-EPOXY-1H-ISOINDOLE-1,3(2H)-DIONE, 2-(2,6-DIOXO-3-PIPERIDINYL)HEXAHYDRO-, (3AR,4S,7R,7AS)-REL-
Database identifiers
- CAS
14166-29-1- PubChem CID
- 167016
- UNII
- TCQ0V2ZG5C
- Nikkaji
- J389.043K
Properties
Computed structural properties
- XLogP
- -1.3
- Topological polar surface area
- 92.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 517
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Related reactions
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Compound notes
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