1-(1,2-Dimethyl-1H-pyrrolo(3,2-c)cinnolin-3-yl)ethanone
Basic information
- CAS
82157-88-8- Standard SMILES
CC(=O)c1c(C)n(C)c2c1nnc1ccccc12- InChIKey
LMLWGKUBBGQXPP-UHFFFAOYSA-N- Molecular formula
- C14H13N3O
- Average molar mass
- 239.27 g/mol
- Monoisotopic mass
- 239.10586205
Names & identifiers
- Preferred name
- 1-(1,2-Dimethyl-1H-pyrrolo(3,2-c)cinnolin-3-yl)ethanone
- IUPAC
- 1-(1,2-dimethylpyrrolo[3,2-c]cinnolin-3-yl)ethanone
Names & synonyms
82157-88-8IH1L3XQE7W1-(1,2-Dimethyl-1H-pyrrolo(3,2-c)cinnolin-3-yl)ethanoneUNII-IH1L3XQE7WNSC 365081NSC-365081DTXSID402315981-(1,2-Dimethyl-1H-pyrrolo[3,2-c]cinnolin-3-yl)ethanoneETHANONE, 1-(1,2-DIMETHYL-1H-PYRROLO(3,2-C)CINNOLIN-3-YL)-RefChem:73868DTXCID701540891-(1,2-dimethylpyrrolo[3,2-c]cinnolin-3-yl)ethanone
Show more names
NSC365081CHEMBL1968849NCI60_0033601-(1,2-Dimethyl-1H-pyrrolo[3,2-c]cinnolin-3-yl)ethan-1-one
Database identifiers
- CAS
82157-88-8- PubChem CID
- 339250
- DTXSID
DTXSID40231598- ChEMBL
CHEMBL1968849- UNII
- IH1L3XQE7W
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 47.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 346
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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