Basic information
- Standard SMILES
CS(=O)(=O)c1ccc(C(=N)Nc2ccc(Cl)cc2)cc1- InChIKey
DVUUUZVZGVQDGQ-UHFFFAOYSA-N- Molecular formula
- C14H13ClN2O2S
- Average molar mass
- 308.8 g/mol
- Monoisotopic mass
- 308.0386265
Names & identifiers
- Preferred name
- 4-methylsulfonyl-N-[4-chlorophenyl]benzenecarboximidamide
- IUPAC
- N'-(4-chlorophenyl)-4-methylsulfonylbenzenecarboximidamide
Names & synonyms
SCHEMBL5593938SCHEMBL5593941DVUUUZVZGVQDGQ-UHFFFAOYSA-N4-methylsulfonyl-N-[4-chlorophenyl]benzenecarboximidamide
Database identifiers
- PubChem CID
- 22998094
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 80.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 442
Related reactions
3 records
Compound notes
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