Basic information
- CAS
332851-50-0- Standard SMILES
CCc1ccccc1NC(=O)c1cc2n(n1)C(C(F)(F)F)CC(c1ccccc1)N2- InChIKey
DMDSCTDBRKLCFS-UHFFFAOYSA-N- Molecular formula
- C22H21F3N4O
- Average molar mass
- 414.4 g/mol
- Monoisotopic mass
- 414.16674579
Names & identifiers
- Preferred name
- N-(2-ethylphenyl)-5-phenyl-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide
- IUPAC
- N-(2-ethylphenyl)-5-phenyl-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide
Names & synonyms
6076-35-3N-(2-ethylphenyl)-5-phenyl-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamideCBMicro_011635DTXSID20417454SMSF0013444AKOS000559587AKOS025152132CB14799BIM-0011723.P001332851-50-0
Database identifiers
- CAS
332851-50-0- PubChem CID
- 3133663
- DTXSID
DTXSID20417454
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 59 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 595
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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