Basic information
- Standard SMILES
Cc1nc(NNC(=O)[C@H](CC2CCCC2)CN(C=O)OCc2ccccc2)c(F)c(N2CCCC2)n1- InChIKey
RUPKEEXFTIZECY-JOCHJYFZSA-N- Molecular formula
- C26H35FN6O3
- Average molar mass
- 498.6 g/mol
- Monoisotopic mass
- 498.27546716
Names & identifiers
- Preferred name
- ((2R)-2-(cyclopentylmethyl)-3-{2-[5-fluoro-2-methyl-6-(1-pyrrolidinyl)-4-pyrimidinyl]hydrazino}-3-oxopropyl)[(phenylmethyl)oxy]formamide
- IUPAC
- N-[(2R)-2-(cyclopentylmethyl)-3-[2-(5-fluoro-2-methyl-6-pyrrolidin-1-ylpyrimidin-4-yl)hydrazinyl]-3-oxopropyl]-N-phenylmethoxyformamide
Names & synonyms
SCHEMBL1189896RUPKEEXFTIZECY-JOCHJYFZSA-N((2R)-2-(cyclopentylmethyl)-3-{2-[5-fluoro-2-methyl-6-(1-pyrrolidinyl)-4-pyrimidinyl]hydrazino}-3-oxopropyl)[(phenylmethyl)oxy]formamide
Database identifiers
- PubChem CID
- 86636916
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 99.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 11
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 685
Related reactions
2 records
Compound notes
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