Basic information
- Standard SMILES
Cc1cc(-c2cnc(N3C[C@@H](C)O[C@@H](C)C3)nc2Cl)ccn1- InChIKey
MXZFQBOERPWURX-TXEJJXNPSA-N- Molecular formula
- C16H19ClN4O
- Average molar mass
- 318.8 g/mol
- Monoisotopic mass
- 318.1247389
Names & identifiers
- Preferred name
- cis-4-(4-Chloro-5-(2-methylpyridin-4-yl)pyrimidin-2-yl)-2,6-dimethylmorpholine
- IUPAC
- (2R,6S)-4-[4-chloro-5-(2-methyl-4-pyridinyl)pyrimidin-2-yl]-2,6-dimethylmorpholine
Names & synonyms
SCHEMBL2722412MXZFQBOERPWURX-TXEJJXNPSA-Ncis-4-(4-chloro-5-(2-methylpyridin-4-yl)pyrimidin-2-yl)-2,6-dimethylmorpholinecis-4-[4-Chloro-5-(2-methyl-4-pyridinyl)-2-pyrimidinyl]-2,6-dimethylmorpholine
Database identifiers
- PubChem CID
- 86702425
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 51.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 362
Related reactions
7 records
Compound notes
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