trans-N-(4-{2-[4-(2,3-Dihydro-furo[3,2-c]pyridin-4-yl)-piperazin-1-yl]-ethyl}-cyclohexyl)-3-(5-methyl-[1,2,4]oxadiazol-3-yl)-benzamide
Basic information
- Standard SMILES
Cc1nc(-c2cccc(C(=O)NC3CCC(CCN4CCN(c5nccc6c5CCO6)CC4)CC3)c2)no1- InChIKey
DZYJECJNISMMEC-UHFFFAOYSA-N- Molecular formula
- C29H36N6O3
- Average molar mass
- 516.6 g/mol
Names & identifiers
- Preferred name
- trans-N-(4-{2-[4-(2,3-Dihydro-furo[3,2-c]pyridin-4-yl)-piperazin-1-yl]-ethyl}-cyclohexyl)-3-(5-methyl-[1,2,4]oxadiazol-3-yl)-benzamide
- IUPAC
- N-[4-[2-[4-(2,3-dihydrofuro[3,2-c]pyridin-4-yl)piperazin-1-yl]ethyl]cyclohexyl]-3-(5-methyl-1,2,4-oxadiazol-3-yl)benzamide
Names & synonyms
SCHEMBL1698549SCHEMBL1698555CHEMBL3642803DZYJECJNISMMEC-SAIGFBBZSA-NBDBM106538US8586579, 154trans-N-(4-{2-[4-(2,3-Dihydro-furo[3,2-c]pyridin-4-yl)-piperazin-1-yl]-ethyl}-cyclohexyl)-3-(5-methyl-[1,2,4]oxadiazol-3-yl)-benzamide
Database identifiers
- PubChem CID
- 54771971
- ChEMBL
CHEMBL3642803
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 96.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 7
- Heavy atoms
- 38
- Formal charge
- 0
- Complexity
- 771
Related reactions
1 records
Compound notes
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