Basic information
- Standard SMILES
O=C(NC1CCC(CCN2CCN(c3nccc4c3CCO4)CC2)CC1)C1(O)CCC1- InChIKey
WPDISOIHGGRFRZ-UHFFFAOYSA-N- Molecular formula
- C24H36N4O3
- Average molar mass
- 428.6 g/mol
Names & identifiers
- Preferred name
- 1-Hydroxy-cyclobutanecarboxylic acid trans-(4-{2-[4-(2,3-dihydro-furo[3,2-c]pyridin-4-yl)-piperazin-1-yl]-ethyl}-cyclohexyl)-amide
- IUPAC
- N-[4-[2-[4-(2,3-dihydrofuro[3,2-c]pyridin-4-yl)piperazin-1-yl]ethyl]cyclohexyl]-1-hydroxycyclobutane-1-carboxamide
Names & synonyms
SCHEMBL1698480CHEMBL3642799SCHEMBL12074682WPDISOIHGGRFRZ-WGSAOQKQSA-NBDBM106534US8586579, 1231-Hydroxy-cyclobutanecarboxylic acid trans-(4-{2-[4-(2,3-dihydro-furo[3,2-c]pyridin-4-yl)-piperazin-1-yl]-ethyl}-cyclohexyl)-amide
Database identifiers
- PubChem CID
- 54771740
- ChEMBL
CHEMBL3642799
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 77.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 612
Related reactions
1 records
Compound notes
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