Enazadrem
Basic information
- CAS
107361-33-1- Standard SMILES
Cc1nc(NCCCCCCc2ccccc2)nc(C)c1O- InChIKey
NRGYTONERIQIBW-UHFFFAOYSA-N- Molecular formula
- C18H25N3O
- Average molar mass
- 299.4 g/mol
- Monoisotopic mass
- 299.19976243
Overview
Enazadrem is a small molecule drug. Enazadrem has a monoisotopic molecular weight of 299.2 Da.
Names & identifiers
- Preferred name
- Enazadrem
- IUPAC
- 4,6-dimethyl-2-(6-phenylhexylamino)pyrimidin-5-ol
- English name
- Enazadrem
- Molecular formula
- C18H25N3O
- Molecular weight
- 299.415
Names & synonyms
enazadrem107361-33-1Enazadrem [INN]UNII-GDV807GKADGDV807GKADCP-70490DTXSID101480284,6-DIMETHYL-2-((6-PHENYLHEXYL)AMINO)-5-PYRIMIDINOL5-PYRIMIDINOL, 4,6-DIMETHYL-2-((6-PHENYLHEXYL)AMINO)-enazadremumRefChem:136746DTXCID1070519
Show more names
5-Pyrimidinol, 4,6-dimethyl-2-[(6-phenylhexyl)amino]-
4,6-dimethyl-2-(6-phenylhexylamino)pyrimidin-5-olCHEMBL859594,6-dimethyl-2-[(6-phenylhexyl)amino]pyrimidin-5-olSCHEMBL635505orb1709763HEA36133BDBM50006815HY-U00024
Database identifiers
- CAS
107361-33-1- PubChem CID
- 60816
- DTXSID
DTXSID10148028- ChEMBL
CHEMBL85959- UNII
- GDV807GKAD
- Nikkaji
- J550.709J
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 58 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 282
Physicochemical properties
- Melting point
- 43 · 43-45 °C
- Boiling point
- 492.3 · 492.3±47.0 °C(Predicted)
- Density
- 1 · 1+-.0.06 g/cm3(Predicted)
- storage temp.
- -20 °C · Store at -20°C
- solubility
- Soluble in DMSO
- form
- Solid
- pka
- 8.43 · 8.43±0.46(Predicted)
- color
- Light brown to black
- FDA UNII
- 807 GKAD · GDV807GKAD
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-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-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Applications
UsesAntipsoriatic; inhibitor (5-lipoxygenase).
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Related reactions
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Compound notes
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