Basic information
- CAS
5430-55-7- Standard SMILES
Nc1nc(CN2CCOCC2)c(Br)c(CN2CCOCC2)n1- InChIKey
IKVVTVSBWAABCQ-UHFFFAOYSA-N- Molecular formula
- C14H22BrN5O2
- Average molar mass
- 372.26 g/mol
- Monoisotopic mass
- 371.09569
Names & identifiers
- Preferred name
- 2-Pyrimidinamine,5-bromo-4,6-bis(4-morpholinylmethyl)-
- IUPAC
- 5-bromo-4,6-bis(morpholin-4-ylmethyl)pyrimidin-2-amine
Names & synonyms
NSC138155430-55-72-Pyrimidinamine,5-bromo-4,6-bis(4-morpholinylmethyl)-DTXSID50279724NSC-13815DS-0137135-Bromo-4,6-bis[(morpholin-4-yl)methyl]pyrimidin-2-amine
Database identifiers
- CAS
5430-55-7- PubChem CID
- 224947
- DTXSID
DTXSID50279724
Properties
Computed structural properties
- XLogP
- -0.5
- Topological polar surface area
- 76.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 309
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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