Basic information
- Standard SMILES
COc1nc2ccccc2nc1NC(=S)Oc1ccccc1- InChIKey
BDOZOZBWZQULCA-UHFFFAOYSA-N- Molecular formula
- C16H13N3O2S
- Average molar mass
- 311.4 g/mol
Names & identifiers
- Preferred name
- Phenyl N-(2-methoxyquinoxalin-3-yl)thiocarbamate
- IUPAC
- O-phenyl N-(3-methoxyquinoxalin-2-yl)carbamothioate
Names & synonyms
SCHEMBL6559651BDOZOZBWZQULCA-UHFFFAOYSA-NPhenyl N-(2-methoxyquinoxalin-3-yl)thiocarbamate
Database identifiers
- PubChem CID
- 53676590
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 88.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 376
Related reactions
16 records
Compound notes
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