Basic information
- Standard SMILES
COC(=O)c1ccc(S(=O)(=O)NCc2ccc3c(cnn3C)c2)c(C)c1- InChIKey
LPDHCKJZTCGCFW-UHFFFAOYSA-N- Molecular formula
- C18H19N3O4S
- Average molar mass
- 373.4 g/mol
Names & identifiers
- Preferred name
- methyl 3-methyl-4-(N-((1-methyl-1H-indazol-5-yl)methyl)sulfamoyl)benzoate
- IUPAC
- methyl 3-methyl-4-[(1-methylindazol-5-yl)methylsulfamoyl]benzoate
Names & synonyms
SCHEMBL904733LPDHCKJZTCGCFW-UHFFFAOYSA-Nmethyl 3-methyl-4-(N-((1-methyl-1H-indazol-5-yl)methyl)sulfamoyl)benzoate
Database identifiers
- PubChem CID
- 66837895
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 98.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 606
Related reactions
2 records
Compound notes
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