Basic information
- Standard SMILES
c1cc2c(-c3nc(N4CCOCC4)c4nc(CN5CC(N6CCOCC6)C5)sc4n3)cncc2[nH]1- InChIKey
XBUIKJOPYRNTKB-UHFFFAOYSA-N- Molecular formula
- C24H28N8O2S
- Average molar mass
- 492.6 g/mol
- Monoisotopic mass
- 492.20559334
Names & identifiers
- Preferred name
- 4-(1-((7-morpholino-5-(1H-pyrrolo[2,3-c]pyridin-4-yl)thiazolo[5,4-d]pyrimidin-2-yl)methyl)azetidin-3-yl)morpholine
- IUPAC
- 4-[2-[(3-morpholin-4-ylazetidin-1-yl)methyl]-5-(1H-pyrrolo[2,3-c]pyridin-4-yl)-[1,3]thiazolo[5,4-d]pyrimidin-7-yl]morpholine
Names & synonyms
SCHEMBL2673973XBUIKJOPYRNTKB-UHFFFAOYSA-N4-(1-((7-morpholino-5-(1H-pyrrolo[2,3-c]pyridin-4-yl)thiazolo[5,4-d]pyrimidin-2-yl)methyl)azetidin-3-yl)morpholine
Database identifiers
- PubChem CID
- 59605885
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 124 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 5
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 720
Related reactions
2 records
Compound notes
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