Basic information
- Standard SMILES
NC(=O)c1c(Cl)c(-c2ccccc2)n2c1CN(S(=O)(=O)Nc1ccccc1)CC2- InChIKey
WSDDCVCRAOXIMT-UHFFFAOYSA-N- Molecular formula
- C20H19ClN4O3S
- Average molar mass
- 430.9 g/mol
- Monoisotopic mass
- 430.0866393
Names & identifiers
- Preferred name
- 7-Chloro-6-phenyl-2-phenylsulfamoyl-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazine-8-carboxylic acid amide
- IUPAC
- 7-chloro-6-phenyl-2-(phenylsulfamoyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-8-carboxamide
Names & synonyms
SCHEMBL4043718WSDDCVCRAOXIMT-UHFFFAOYSA-N7-chloro-6-phenyl-2-phenylsulfamoyl-1,2,3,4-tetrahydro-pyrrolo[1,2-a]pyrazine-8-carboxylic acid amide7-chloro-6-phenyl-2-phenylsulfamoyl-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazine-8-carboxylic acid amide
Database identifiers
- PubChem CID
- 58762010
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 106 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 688
Related reactions
2 records
Compound notes
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