Basic information
- Standard SMILES
C[C@H]1COCc2nc3c(N)nc4cc(/C=C/C(=O)N(C)C)ccc4c3n21- InChIKey
ZKNASHFKDZXXPW-ZRQQLDRUSA-N- Molecular formula
- C19H21N5O2
- Average molar mass
- 351.4 g/mol
- Monoisotopic mass
- 351.16952493
Names & identifiers
- Preferred name
- (2E)-3-[(11S)-6-amino-11-methyl-10,11-dihydro-8H-[1,4]oxazino[4',3':1,2]imidazo[4,5-c]quinolin-3-yl]-N,N-dimethylprop-2-enamide
- IUPAC
- (E)-3-[(16S)-9-amino-16-methyl-14-oxa-8,11,17-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2(7),3,5,8,11-hexaen-5-yl]-N,N-dimethylprop-2-enamide
Names & synonyms
SCHEMBL1774266ZKNASHFKDZXXPW-ZRQQLDRUSA-N(2E)-3-[(11S)-6-amino-11-methyl-10,11-dihydro-8H-[1,4]oxazino[4',3':1,2]imidazo[4,5-c]quinolin-3-yl]-N,N-dimethylprop-2-enamide
Database identifiers
- PubChem CID
- 67156540
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 86.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 568
Related reactions
6 records
Compound notes
Loading…