Basic information
- CAS
143343-82-2- Standard SMILES
COc1cccc(CNCC(O)COc2ccc3[nH]c(=O)ccc3c2)c1- InChIKey
SMFUDVJKOUBSBI-UHFFFAOYSA-N- Molecular formula
- C20H22N2O4
- Average molar mass
- 354.4 g/mol
- Monoisotopic mass
- 354.15795719
Overview
structure given in first source
Names & identifiers
- Preferred name
- Opc 18750
- IUPAC
- 6-[2-hydroxy-3-[(3-methoxyphenyl)methylamino]propoxy]-1H-quinolin-2-one
Names & synonyms
Opc 18750143343-82-2Opc-18750OPC18750RefChem:168328(+-)-6-(2-Hydroxy-3-((3-methoxybenzyl)amino)propoxy)-2(1H)-quinolinone6-[2-hydroxy-3-[(3-methoxyphenyl)methylamino]propoxy]-1H-quinolin-2-oneCHEMBL333314orb1695805SCHEMBL6650940DTXSID60931826AKOS040753377
Show more names
T338066-(2-Hydroxy-3-{[(3-methoxyphenyl)methyl]amino}propoxy)quinolin-2(1H)-one
Database identifiers
- CAS
143343-82-2- PubChem CID
- 197484
- DTXSID
DTXSID60931826- ChEMBL
CHEMBL333314
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 79.8 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 484
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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