Basic information
- CAS
1211027-43-8- Standard SMILES
CCCn1c(N)c(C(=O)CN(Cc2ccc(C(=O)NCC(F)(F)F)cc2)C2CC2)c(=O)n(C)c1=O- InChIKey
BWVAMVQUEINIOX-UHFFFAOYSA-N- Molecular formula
- C23H28F3N5O4
- Average molar mass
- 495.5 g/mol
- Monoisotopic mass
- 495.20933888
Names & identifiers
- Preferred name
- 4-[[[2-(6-Amino-1,2,3,4-tetrahydro-3-methyl-2,4-dioxo-1-propyl-5-pyrimidinyl)-2-oxoethyl]cyclopropylamino]methyl]-N-(2,2,2-trifluoroethyl)benzamide
- IUPAC
- 4-[[[2-(4-amino-1-methyl-2,6-dioxo-3-propylpyrimidin-5-yl)-2-oxoethyl]-cyclopropylamino]methyl]-N-(2,2,2-trifluoroethyl)benzamide
Names & synonyms
DTXSID001100532AKOS0081099181211027-43-84-[[[2-(6-Amino-1,2,3,4-tetrahydro-3-methyl-2,4-dioxo-1-propyl-5-pyrimidinyl)-2-oxoethyl]cyclopropylamino]methyl]-N-(2,2,2-trifluoroethyl)benzamideZ319169360
Database identifiers
- CAS
1211027-43-8- PubChem CID
- 36927346
- DTXSID
DTXSID001100532
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 116 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 10
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 879
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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