Basic information
- Standard SMILES
COC(=O)[C@H]1CCCN1c1ncnc(Nc2cccc(CS(N)(=O)=O)c2)n1- InChIKey
JANQIQYGKXQMNN-CYBMUJFWSA-N- Molecular formula
- C16H20N6O4S
- Average molar mass
- 392.4 g/mol
- Monoisotopic mass
- 392.12667431
Names & identifiers
- Preferred name
- (R)-Methyl 1-[4-((3-(Sulfamoylmethyl)phenyl)amino)-1,3,5-triazin-2-yl]pyrrolidine-2-carboxylate
- IUPAC
- methyl (2R)-1-[4-[3-(sulfamoylmethyl)anilino]-1,3,5-triazin-2-yl]pyrrolidine-2-carboxylate
Names & synonyms
SCHEMBL15836595JANQIQYGKXQMNN-CYBMUJFWSA-N(R)-Methyl 1-[4-((3-(Sulfamoylmethyl)phenyl)amino)-1,3,5-triazin-2-yl]pyrrolidine-2-carboxylate
Database identifiers
- PubChem CID
- 60197308
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 149 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 7
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 613
Related reactions
1 records
Compound notes
Loading…