WY 48989
Basic information
- CAS
136917-40-3- Standard SMILES
N#Cc1ccc(NCCc2nc3cc(Cl)ccc3c3nn(-c4ccccc4)cc23)cc1- InChIKey
GYVYUQVVKBZPRY-UHFFFAOYSA-N- Molecular formula
- C25H18ClN5
- Average molar mass
- 423.9 g/mol
- Monoisotopic mass
- 423.1250733
Overview
inhibits interleukin-1 induced neutral protease
Names & identifiers
- Preferred name
- WY 48989
- IUPAC
- 4-[2-(7-chloro-2-phenylpyrazolo[4,3-c]quinolin-4-yl)ethylamino]benzonitrile
Names & synonyms
WY 48989136917-40-3WY-48,989DTXSID90160006RefChem:934265DTXCID50824974-((2-(7-Chloro-2-phenyl-2H-pyrazolo(4,3-c)quinolin-4-yl)ethyl)amino)benzonitrileWy-489894-[[2-(7-chloro-2-phenyl-2h-pyrazolo[4,3-c]quinolin-4-yl)ethyl]amino]benzonitrile4-{[2-(7-Chloro-2-phenyl-2H-pyrazolo[4,3-c]quinolin-4-yl)ethyl]amino}benzonitrile4-[2-(7-chloro-2-phenylpyrazolo[4,3-c]quinolin-4-yl)ethylamino]benzonitrileSCHEMBL10625720
Show more names
GYVYUQVVKBZPRY-UHFFFAOYSA-N4[[2-(7-Chloro-2-phenyl-2H-pyrazolo[4,3-c]quinolin-4-yl)ethyl]amino]benzonitrile
Database identifiers
- CAS
136917-40-3- PubChem CID
- 132006
- DTXSID
DTXSID90160006- Nikkaji
- J426.130E
Properties
Computed structural properties
- XLogP
- 5.8
- Topological polar surface area
- 66.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 635
Related reactions
2 records
Compound notes
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