Basic information
- Standard SMILES
COc1ccc2c(-c3ccc(OC)c(OC)c3)nnc(NC3CCN(Cc4ccc5ccccc5c4)CC3)c2c1- InChIKey
LBFZABITEIXMHN-UHFFFAOYSA-N- Molecular formula
- C33H34N4O3
- Average molar mass
- 534.6 g/mol
Names & identifiers
- Preferred name
- 4-(3,4-dimethoxyphenyl)-7-methoxy-N-[1-(naphthalen-2-ylmethyl)piperidin-4-yl]phthalazin-1-amine
- IUPAC
- 4-(3,4-dimethoxyphenyl)-7-methoxy-N-[1-(naphthalen-2-ylmethyl)piperidin-4-yl]phthalazin-1-amine
Names & synonyms
SCHEMBL4838589LBFZABITEIXMHN-UHFFFAOYSA-N4-(3,4-dimethoxyphenyl)-7-methoxy-N-[1-(naphthalen-2-ylmethyl)piperidin-4-yl]phthalazin-1-amine
Database identifiers
- PubChem CID
- 69211458
Properties
Computed structural properties
- XLogP
- 6.3
- Topological polar surface area
- 68.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 8
- Heavy atoms
- 40
- Formal charge
- 0
- Complexity
- 779
Related reactions
2 records
Compound notes
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