Basic information
- Standard SMILES
COCCCn1c(C(=O)N(CC(C)C)[C@@H]2CNC[C@H](C(=O)N3CCOCC3)C2)nc2ccccc21- InChIKey
GPUOKVOCDZBVJS-RTWAWAEBSA-N- Molecular formula
- C26H39N5O4
- Average molar mass
- 485.6 g/mol
Names & identifiers
- Preferred name
- 1-(3-methoxypropyl)-N-(2-methylpropyl)-N-[(3S,5R)-5-(morpholin-4-ylcarbonyl)piperidin-3-yl]-1H-benzimidazole-2-carboxamide
- IUPAC
- 1-(3-methoxypropyl)-N-(2-methylpropyl)-N-[(3S,5R)-5-(morpholine-4-carbonyl)piperidin-3-yl]benzimidazole-2-carboxamide
Names & synonyms
SCHEMBL12441132GPUOKVOCDZBVJS-RTWAWAEBSA-N1-(3-methoxypropyl)-N-(2-methylpropyl)-N-[(3S, 5R)-5-(morpholin-4-ylcarbonyl)piperidin-3-yl]-1H-benzimidazole-2-carboxamide1-(3-methoxypropyl)-N-(2-methylpropyl)-N-[(3S,5R)-5-(morpholin-4-ylcarbonyl)piperidin-3-yl]-1H-benzimidazole-2-carboxamide
Database identifiers
- PubChem CID
- 58355145
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 88.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 9
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 701
Related reactions
4 records
Compound notes
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