N-Acetyl-S-(5,8-dimethoxy-2-methyl-4-quinolinyl)cysteine
Basic information
- CAS
1009729-61-6- Standard SMILES
COc1ccc(OC)c2c(SCC(NC(C)=O)C(=O)O)cc(C)nc12- InChIKey
UCXYSNISEUSVRY-UHFFFAOYSA-N- Molecular formula
- C17H20N2O5S
- Average molar mass
- 364.4 g/mol
- Monoisotopic mass
- 364.10929292
Names & identifiers
- Preferred name
- N-Acetyl-S-(5,8-dimethoxy-2-methyl-4-quinolinyl)cysteine
- IUPAC
- 2-acetamido-3-(5,8-dimethoxy-2-methylquinolin-4-yl)sulfanylpropanoic acid
Names & synonyms
N-Acetyl-S-(5,8-dimethoxy-2-methyl-4-quinolinyl)cysteineDTXSID2012013921009729-61-6N-Acetyl-S-(5,8-dimethoxy-2-methylquinolin-4-yl)cysteine
Database identifiers
- CAS
1009729-61-6- PubChem CID
- 4896940
- DTXSID
DTXSID201201392
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 123 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 7
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 478
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…