Basic information
- Standard SMILES
Cc1cc(N2CCc3c(-c4cccc(O)c4)nc(N4CCOCC4)nc32)c2ccccc2n1- InChIKey
VHPOQEOPEUEWGA-UHFFFAOYSA-N- Molecular formula
- C26H25N5O2
- Average molar mass
- 439.5 g/mol
Names & identifiers
- Preferred name
- 3-[7-(2-Methyl-quinolin-4-yl)-2-morpholin-4-yl-6,7-dihydro-5H-pyrrolo[2,3-d]pyrimidin-4-yl]-phenol
- IUPAC
- 3-[7-(2-methylquinolin-4-yl)-2-morpholin-4-yl-5,6-dihydropyrrolo[2,3-d]pyrimidin-4-yl]phenol
Names & synonyms
SCHEMBL2376294VHPOQEOPEUEWGA-UHFFFAOYSA-N3-[7-(2-Methyl-quinolin-4-yl)-2-morpholin-4-yl-6,7-dihydro-5H-pyrrolo[2,3-d]pyrimidin-4-yl]-phenol
Database identifiers
- PubChem CID
- 24889093
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 74.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 3
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 661
Related reactions
2 records
Compound notes
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