Basic information
- Standard SMILES
O=S(=O)(c1ccc(C(F)(F)F)cc1)N1Cc2[nH]ncc2C1C1CC1- InChIKey
CQFGGNHYGQKXEQ-UHFFFAOYSA-N- Molecular formula
- C15H14F3N3O2S
- Average molar mass
- 357.4 g/mol
- Monoisotopic mass
- 357.07588236
Names & identifiers
- Preferred name
- 4-cyclopropyl-5-[4-(trifluoromethyl)phenyl]sulfonyl-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazole
- IUPAC
- 4-cyclopropyl-5-[4-(trifluoromethyl)phenyl]sulfonyl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazole
Names & synonyms
SCHEMBL2194912SCHEMBL2197301CQFGGNHYGQKXEQ-UHFFFAOYSA-N4-cyclopropyl-5-[4-(trifluoromethyl)phenyl]sulfonyl-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazole
Database identifiers
- PubChem CID
- 25113045
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 74.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 3
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 580
Related reactions
1 records
Compound notes
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