N-Cyclopropyl-6-methyl-7-(1-((S)-3-methylmorpholino)phthalazin-6-yl)benzo[d]isoxazol-3-amine
Completing data — refresh the page later to see the latest
Basic information
- Standard SMILES
Cc1ccc2c(NC3CC3)noc2c1-c1ccc2c(N3CCOC[C@@H]3C)nncc2c1- InChIKey
BQZUAHKGFIUDFA-HNNXBMFYSA-N- Molecular formula
- C24H25N5O2
- Average molar mass
- 415.5 g/mol
Names & identifiers
- Preferred name
- N-Cyclopropyl-6-methyl-7-(1-((S)-3-methylmorpholino)phthalazin-6-yl)benzo[d]isoxazol-3-amine
- IUPAC
- N-cyclopropyl-6-methyl-7-[1-[(3S)-3-methylmorpholin-4-yl]phthalazin-6-yl]-1,2-benzoxazol-3-amine
Names & synonyms
CHEMBL522877N-Cyclopropyl-6-methyl-7-(1-((S)-3-methylmorpholino)phthalazin-6-yl)benzo[d]isoxazol-3-amineSCHEMBL2953508BQZUAHKGFIUDFA-HNNXBMFYSA-NBDBM50252736PD081041
Database identifiers
- PubChem CID
- 44568804
- ChEMBL
CHEMBL522877
Properties
Computed structural propertiesFilling in
- XLogP
- 4.3
- Topological polar surface area
- 76.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 633
Related reactions
1 records
Compound notes
Loading…