CP-320626
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Basic information
- CAS
186430-23-9- Standard SMILES
O=C(N[C@@H](Cc1ccc(F)cc1)C(=O)N1CCC(O)CC1)c1cc2cc(Cl)ccc2[nH]1- InChIKey
YDCGVASFVACWKF-NRFANRHFSA-N- Molecular formula
- C23H23ClFN3O3
- Average molar mass
- 443.9 g/mol
Overview
structure in first source
Names & identifiers
- Preferred name
- CP-320626
- IUPAC
- 5-chloro-N-[(2S)-3-(4-fluorophenyl)-1-(4-hydroxypiperidin-1-yl)-1-oxopropan-2-yl]-1H-indole-2-carboxamide
- English name
- CP-320626
- Molecular formula
- C23H23ClFN3O3
- Molecular weight
- 443.9
Names & synonyms
CP-320626186430-23-9FKX709RK3Q1H-Indole-2-carboxamide, 5-chloro-N-((1S)-1-((4-fluorophenyl)methyl)-2-(4-hydroxy-1-piperidinyl)-2-oxoethyl)-5-chloro-N-[(2S)-3-(4-fluorophenyl)-1-(4-hydroxypiperidin-1-yl)-1-oxopropan-2-yl]-1H-indole-2-carboxamideCP 3206261H-Indole-2-carboxamide, 5-chloro-N-(1-((4-fluorophenyl)methyl)-2-(4-hydroxy-1-piperidinyl)-2-oxoethyl)-, (S)-5-chloro-N-((2S)-3-(4-fluorophenyl)-1-(4-hydroxypiperidin-1-yl)-1-oxopropan-2-yl)-1H-indole-2-carboxamideRefChem:579355UNII-FKX709RK3QCHEMBL998895-CHLORO-1H-INDOLE-2-CARBOXYLIC ACID [1-(4-FLUOROBENZYL)-2-(4-HYDROXYPIPERIDIN-1YL)-2-OXOETHYL]AMIDE
Show more names
1H-Indole-2-carboxamide, 5-chloro-N-[(1S)-1-[(4-fluorophenyl)methyl]-2-(4-hydroxy-1-piperidinyl)-2-oxoethyl]-
5-chloro-N-((2S)-3-(4-fluorophenyl)-1-(4-hydroxy-1-piperidinyl)-1-oxo-2-propanyl)-1H-indole-2-carboxamide(S)-5-chloro-N-(3-(4-fluorophenyl)-1-(4-hydroxypiperidin-1-yl)-1-oxopropan-2-yl)-1H-indole-2-carboxamideYDCGVASFVACWKF-NRFANRHFSA-Norb1697702SCHEMBL7234251SCHEMBL29512532BDBM35346cp320626
Database identifiers
- CAS
186430-23-9- PubChem CID
- 444746
- ChEMBL
CHEMBL99889- UNII
- FKX709RK3Q
- Nikkaji
- J992.751D
Properties
Computed structural propertiesFilling in
- XLogP
- 3.8
- Topological polar surface area
- 85.4 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 638
Experimental & physicochemical properties
DrugsPharmaceuticals -> Listed in ZINC15
Physicochemical properties
- Boiling point
- 770.8 · 770.8±60.0 °C(Predicted)
- Density
- 1.401 · 1.401±0.06 g/cm3(Predicted)
- pka
- 14.06 · 14.06±0.46(Predicted)
- FDA UNII
- 709 RK3Q · FKX709RK3Q
Chemistry & industry
Pharmacology
MeSH Pharmacological ClassificationCompounds or agents that combine with an enzyme in such a manner as to prevent the normal substrate-enzyme combination and the catalytic reaction.
Applications
UsesCP320626 is a potent inhibitor of human liver glycogen phosphorylase (IC50=205 nM). CP320626 reduces blood glucose in diabetic mice without changing plasma insulin levels. CP320626 can be used in the study of type 2 diabetes[1].
Related reactions
2 records
Compound notes
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