Basic information
- CAS
122456-25-1- Standard SMILES
COc1cccc2c3c(c(C)nc12)CCN3c1ccccc1C- InChIKey
LRRNXUOMUQEWTP-UHFFFAOYSA-N- Molecular formula
- C20H20N2O
- Average molar mass
- 304.4 g/mol
- Monoisotopic mass
- 304.15756326
Overview
structure given in first source
Names & identifiers
- Preferred name
- SK&F 96079
- IUPAC
- 6-methoxy-4-methyl-1-(2-methylphenyl)-2,3-dihydropyrrolo[3,2-c]quinoline
Names & synonyms
SK&F 96079Skf-96079122456-25-1DTXSID60153622RefChem:183314DTXCID1076113CHEMBL1512516-methoxy-4-methyl-1-(2-methylphenyl)-2,3-dihydropyrrolo[3,2-c]quinolineSCHEMBL9685162LRRNXUOMUQEWTP-UHFFFAOYSA-NBDBM500132281-(2-methylphenyl)-4-methyl-6-methoxy-2,3-dihydropyrrolo[3,2-c]quinoline
Show more names
6-Methoxy-4-methyl-1-o-tolyl-2,3-dihydro-1H-pyrrolo[3,2-c]quinoline6-methoxy-4-methyl-1-(2-methylphenyl)-2,3-dihydro-1H-pyrrolo[3,2-c]quinoline
Database identifiers
- CAS
122456-25-1- PubChem CID
- 196776
- DTXSID
DTXSID60153622- ChEMBL
CHEMBL151251- Nikkaji
- J273.090A
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 25.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 414
Chemistry & industry
Pharmacology
MeSH Pharmacological ClassificationCompounds that inhibit H(+)-K(+)-EXCHANGING ATPASE. They are used as ANTI-ULCER AGENTS and sometimes in place of HISTAMINE H2 ANTAGONISTS for GASTROESOPHAGEAL REFLUX.
Related reactions
4 records
Compound notes
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