1-methylethyl {(2S,4R)-1-acetyl-6-[1-(2-aminoethyl)-1H-imidazol-4-yl]-2-methyl-1,2,3,4-tetrahydro-4-quinolinyl}carbamate hydrochloride
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Basic information
- Standard SMILES
CC(=O)N1c2ccc(-c3cn(CCN)cn3)cc2[C@H](NC(=O)OC(C)C)C[C@@H]1C.Cl- InChIKey
IYGWWDHFWYEVHZ-QLOBERJESA-N- Molecular formula
- C21H30ClN5O3
- Average molar mass
- 435.9 g/mol
Names & identifiers
- Preferred name
- 1-methylethyl {(2S,4R)-1-acetyl-6-[1-(2-aminoethyl)-1H-imidazol-4-yl]-2-methyl-1,2,3,4-tetrahydro-4-quinolinyl}carbamate hydrochloride
- IUPAC
- propan-2-yl N-[(2S,4R)-1-acetyl-6-[1-(2-aminoethyl)imidazol-4-yl]-2-methyl-3,4-dihydro-2H-quinolin-4-yl]carbamate;hydrochloride
Names & synonyms
IYGWWDHFWYEVHZ-QLOBERJESA-N1-methylethyl {(2S,4R)-1-acetyl-6-[1-(2-aminoethyl)-1H-imidazol-4-yl]-2-methyl-1,2,3,4-tetrahydro-4-quinolinyl}carbamate hydrochloride
Database identifiers
- PubChem CID
- 52934331
Properties
Computed structural propertiesFilling in
- Topological polar surface area
- 102 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 587
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Related reactions
1 records
Compound notes
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