Basic information
- CAS
92788-10-8- Standard SMILES
CCC1(c2ccncc2)CCC(=O)NC1=O- InChIKey
QXKJWHWUDVQATH-UHFFFAOYSA-N- Molecular formula
- C12H14N2O2
- Average molar mass
- 218.25 g/mol
- Monoisotopic mass
- 218.10552769
Overview
Rogletimide is an orally active aminoglutethimide derivative with potential antineoplastic activity. Rogletimide reversibly inhibits the activity of aromatase, a cytochrome P450 family enzyme found in many tissues and the key enzyme in the oxidative aromatization process of androgens to estrogens. In estrogen-dependent cancers, the inhibition of aromatase by this agent leads to a reduction in the synthesis of estrogen, thereby inhibiting estrogen-mediated signal transduction and consequently reducing tumor cell growth. In addition, rogletimide also inhibits enzymes that catalyzing conversion of cholesterol to corticosteroids.
Names & identifiers
- Preferred name
- Rogletimide
- IUPAC
- 3-ethyl-3-pyridin-4-ylpiperidine-2,6-dione
- English name
- (+/-) 3-Ethyl-3-(4-pyridinyl)-2,6-piperidinedione
- Molecular formula
- C12H14N2O2
- Molecular weight
- 218.25
Names & synonyms
ROGLETIMIDEPyridoglutethimide92788-10-8Rogletimida3-PYG2-Ethyl-2-(4-pyridyl)glutarimide2,6-Piperidinedione, 3-ethyl-3-(4-pyridinyl)-3-Ethyl-3-(4-pyridyl)piperidine-2,6-dione14P4QR28QFDTXSID60869670NSC619778Rogletimidum
Show more names
RSYYRogletimidePyridylglutarimideRacemic-pyridoglutethimide3-Ethyl-3-(4-pyridinyl)piperidine-2,6-dione(+-)3-ETHYL-3-(4-PYRIDINYL)-2,6-PIPERIDINEDIONE
RefChem:930862DTXCID80817618121840-95-73-ethyl-3-(pyridin-4-yl)piperidine-2,6-dione3-ethyl-3-pyridin-4-ylpiperidine-2,6-dioneCHEMBL289116Pyridoglutethimide; Racemic pyridoglutethimide(+-)-Pyridoglutethimide
Database identifiers
- CAS
92788-10-8- PubChem CID
- 56487
- DTXSID
DTXSID60869670- ChEMBL
CHEMBL289116- UNII
- 14P4QR28QF
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 59.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 297
Experimental & physicochemical properties
LogP0.58
Physicochemical properties
- EWG's Food Scores
- 1 · 1
- FDA UNII
- 14 P4QR28QF · 14P4QR28QF
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers4 total
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
上海兰科化学有限公司021-61916491 15921747686 · [email protected]
济南睿思医药技术有限公司0531-0531-69900633 19963472814 · [email protected]
烟台盛凯伦化学科技有限公司开发区第一分公司13356901049 · [email protected]
Related reactions
1 records
Compound notes
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