Basic information
- CAS
139543-40-1- Standard SMILES
CC(C)Oc1cccc(-n2c(CCc3c[nH]c4ccc(Cl)cc34)nc3ccccc3c2=O)c1- InChIKey
DWDPCGQQNLAFEN-UHFFFAOYSA-N- Molecular formula
- C27H24ClN3O2
- Average molar mass
- 457.9 g/mol
- Monoisotopic mass
- 457.1557047
Overview
LY-202769 is a member of quinazolines.
Names & identifiers
- Preferred name
- 2-(2-(5-Chloro-1H-indol-3-yl)ethyl)-3-(3-(1-methylethoxy)phenyl)-4(3H)-quinazolinone
- IUPAC
- 2-[2-(5-chloro-1H-indol-3-yl)ethyl]-3-(3-propan-2-yloxyphenyl)quinazolin-4-one
- English name
- LY 202769
- Molecular formula
- C27H24ClN3O2
- Molecular weight
- 457.95136
Names & synonyms
139543-40-1LY 202769LY 202,7692-[2-(5-Chloro-1H-indol-3-yl)ethyl]-3-[3-(1-methylethoxy)phenyl]-4(3H)-quinazolinoneDTXSID201610814(3H)-Quinazolinone, 2-(2-(5-chloro-1H-indol-3-yl)ethyl)-3-(3-(1-methylethoxy)phenyl)-LY202769LY-202,7694(3H)-Quinazolinone, 2-[2-(5-chloro-1H-indol-3-yl)ethyl]-3-[3-(1-methylethoxy)phenyl]-2-(2-(5-Chloro-1H-indol-3-yl)ethyl)-3-(3-(1-methylethoxy)phenyl)-4(3H)-quinazolinoneRefChem:909130DTXCID7083572
Show more names
LY-2027692-[2-(5-chloro-1H-indol-3-yl)ethyl]-3-(3-propan-2-yloxyphenyl)quinazolin-4-oneorb1738703CHEBI:79623Q271487442-[2-(5-Chloro-1H-indol-3-yl)ethyl]-3-{3-[(propan-2-yl)oxy]phenyl}quinazolin-4(3H)-one
Database identifiers
- CAS
139543-40-1- PubChem CID
- 63333
- DTXSID
DTXSID20161081
Properties
Computed structural properties
- XLogP
- 5.8
- Topological polar surface area
- 57.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 728
Chemistry & industry
Applications
DescriptionLY 202769 is a cholecystokinin-B antagonist.
Suppliers2 total
上海陶术生物科技股份有限公司13564774135 · [email protected]
TargetMol中国（陶术生物）15002134094 · [email protected]
Additional notes
DefinitionChEBI: LY-202769 is a member of quinazolines.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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