Basic information
- Standard SMILES
COCCc1ccc(OCC(O)CNCCNC(=O)c2ccc(-n3ccnc3)cc2)cc1- InChIKey
UNEPTPUBKUXFLT-UHFFFAOYSA-N- Molecular formula
- C24H30N4O4
- Average molar mass
- 438.5 g/mol
Names & identifiers
- Preferred name
- N-[2-[[2-Hydroxy-3-(4-(2-methoxyethyl)phenoxy)propyl]amino]ethyl]-4-(1H-imidazol-1-yl)benzamide
- IUPAC
- N-[2-[[2-hydroxy-3-[4-(2-methoxyethyl)phenoxy]propyl]amino]ethyl]-4-imidazol-1-ylbenzamide
Names & synonyms
CHEMBL99532SCHEMBL8781124UNEPTPUBKUXFLT-UHFFFAOYSA-NBDBM50228535N-[2-[[2-Hydroxy-3-(4-(2-methoxyethyl)phenoxy)propyl]amino]ethyl]-4-(1H-imidazol-1-yl)benzamide
Database identifiers
- PubChem CID
- 14739880
- ChEMBL
CHEMBL99532- Nikkaji
- J347.681B
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 97.6 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 13
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 522
Related reactions
1 records
Compound notes
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