Basic information
- Standard SMILES
CN(CCN1C(=O)CCc2cc(NC(=N)c3cccs3)ccc21)C(=O)Oc1ccccc1- InChIKey
DMFUPHIIBAGOGE-UHFFFAOYSA-N- Molecular formula
- C24H24N4O3S
- Average molar mass
- 448.5 g/mol
- Monoisotopic mass
- 448.15691181
Names & identifiers
- Preferred name
- Phenyl methyl(2-(2-oxo-6-(thiophene-2-carboximidamido)-3,4-dihydroquinolin-1(2H)-yl)ethyl)carbamate
- IUPAC
- phenyl N-[2-[6-[[amino(thiophen-2-yl)methylidene]amino]-2-oxo-3,4-dihydroquinolin-1-yl]ethyl]-N-methylcarbamate
Names & synonyms
SCHEMBL2675820DMFUPHIIBAGOGE-UHFFFAOYSA-NPhenyl methyl(2-(2-oxo-6-(thiophene-2-carboximidamido)-3,4-dihydroquinolin-1(2H)-yl)ethyl)carbamate
Database identifiers
- PubChem CID
- 59807096
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 116 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 697
Related reactions
5 records
Compound notes
Loading…