Basic information
- Standard SMILES
COc1cc(Nc2nc(Cl)nc3scnc23)cc(N2CCC[C@@H]2C)c1- InChIKey
RXJUGQMGVFIBKZ-JTQLQIEISA-N- Molecular formula
- C17H18ClN5OS
- Average molar mass
- 375.9 g/mol
Names & identifiers
- Preferred name
- (S)-5-chloro-N-(3-methoxy-5-(2-methylpyrrolidin-1-yl)phenyl)thiazolo[5,4-d]pyrimidin-7-amine
- IUPAC
- 5-chloro-N-[3-methoxy-5-[(2S)-2-methylpyrrolidin-1-yl]phenyl]-[1,3]thiazolo[5,4-d]pyrimidin-7-amine
Names & synonyms
SCHEMBL12802891RXJUGQMGVFIBKZ-JTQLQIEISA-N(S)-5-chloro-N-(3-methoxy-5-(2-methylpyrrolidin-1-yl)phenyl)thiazolo[5,4-d]pyrimidin-7-amine
Database identifiers
- PubChem CID
- 86671792
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 91.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 461
Related reactions
3 records
Linked notes
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