(S)-1-(2-(2,6-dimethylphenyl)-4-(4-methoxy-3,3-dimethylpiperidin-1-yl)-7,8-dihydropyrido[4,3-d]pyrimidin-6(5H)-yl)-4-methylpentane-1,3-dione
Basic information
- Standard SMILES
CO[C@H]1CCN(c2nc(-c3c(C)cccc3C)nc3c2CN(C(=O)CC(=O)C(C)C)CC3)CC1(C)C- InChIKey
QHXDUVLMDMRUMQ-DEOSSOPVSA-N- Molecular formula
- C29H40N4O3
- Average molar mass
- 492.7 g/mol
Names & identifiers
- Preferred name
- (S)-1-(2-(2,6-dimethylphenyl)-4-(4-methoxy-3,3-dimethylpiperidin-1-yl)-7,8-dihydropyrido[4,3-d]pyrimidin-6(5H)-yl)-4-methylpentane-1,3-dione
- IUPAC
- 1-[2-(2,6-dimethylphenyl)-4-[(4S)-4-methoxy-3,3-dimethylpiperidin-1-yl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl]-4-methylpentane-1,3-dione
Names & synonyms
SCHEMBL14663079QHXDUVLMDMRUMQ-DEOSSOPVSA-N(S)-1-(2-(2,6-dimethylphenyl)-4-(4-methoxy-3,3-dimethylpiperidin-1-yl)-7,8-dihydropyrido[4,3-d]pyrimidin-6(5H)-yl)-4-methylpentane-1,3-dione
Database identifiers
- PubChem CID
- 89397283
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 75.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 776
Related reactions
1 records
Compound notes
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