Basic information
- Standard SMILES
Cc1nc(NCc2ccccn2)c(F)c(NNC(=O)[C@H](CC2CCCC2)CN(C=O)OCc2ccccc2)n1- InChIKey
FVOSSOLGIKRPPP-HSZRJFAPSA-N- Molecular formula
- C28H34FN7O3
- Average molar mass
- 535.6 g/mol
- Monoisotopic mass
- 535.27071613
Names & identifiers
- Preferred name
- [(2R)-2-(cyclopentylmethyl)-3-(2-{5-fluoro-2-methyl-6-[(2-pyridinylmethyl)amino]-4-pyrimidinyl}hydrazino)-3-oxopropyl][(phenylmethyl)oxy]formamide
- IUPAC
- N-[(2R)-2-(cyclopentylmethyl)-3-[2-[5-fluoro-2-methyl-6-(pyridin-2-ylmethylamino)pyrimidin-4-yl]hydrazinyl]-3-oxopropyl]-N-phenylmethoxyformamide
Names & synonyms
SCHEMBL1189502FVOSSOLGIKRPPP-HSZRJFAPSA-N[(2R)-2-(cyclopentylmethyl)-3-(2-{5-fluoro-2-methyl-6-[(2-pyridinylmethyl)amino]-4-pyrimidinyl}hydrazino)-3-oxopropyl][(phenylmethyl)oxy]formamide
Database identifiers
- PubChem CID
- 86636947
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 121 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 13
- Heavy atoms
- 39
- Formal charge
- 0
- Complexity
- 738
Related reactions
2 records
Compound notes
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