Basic information
- Standard SMILES
CN(C)c1cccc(N2CCc3c(-c4cccc(O)c4)nc(N4CCOCC4)nc32)c1- InChIKey
NTRRKCRZOLUXCF-UHFFFAOYSA-N- Molecular formula
- C24H27N5O2
- Average molar mass
- 417.5 g/mol
Names & identifiers
- Preferred name
- 3-[7-(3-Dimethylamino-phenyl)-2-morpholin-4-yl-6,7-dihydro-5H-pyrrolo[2,3-d]pyrimidin-4-yl]-phenol
- IUPAC
- 3-[7-[3-(dimethylamino)phenyl]-2-morpholin-4-yl-5,6-dihydropyrrolo[2,3-d]pyrimidin-4-yl]phenol
Names & synonyms
SCHEMBL2376985NTRRKCRZOLUXCF-UHFFFAOYSA-N3-[7-(3-Dimethylamino-phenyl)-2-morpholin-4-yl-6,7-dihydro-5H-pyrrolo[2,3-d]pyrimidin-4-yl]-phenol
Database identifiers
- PubChem CID
- 24889094
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 65 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 586
Related reactions
2 records
Compound notes
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