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Basic information
- Standard SMILES
COC(=O)NC(C(=O)N1CCCC1c1nc(-c2ccc(-c3ccc(C(=O)CNC(=O)C4CCC5(CCOCC5)N4C(C)=O)cc3)cc2)c[nH]1)C(C)C- InChIKey
UESRQJMEOUFQSC-UHFFFAOYSA-N- Molecular formula
- C39H48N6O7
- Average molar mass
- 712.8 g/mol
- Monoisotopic mass
- 712.35844789
Names & identifiers
- Preferred name
- methyl N-[1-[2-[5-[4-[4-[2-[(1-acetyl-8-oxa-1-azaspiro[4.5]decane-2-carbonyl)amino]acetyl]phenyl]phenyl]-1H-imidazol-2-yl]pyrrolidin-1-yl]-3-methyl-1-oxobutan-2-yl]carbamate
- IUPAC
- methyl N-[1-[2-[5-[4-[4-[2-[(1-acetyl-8-oxa-1-azaspiro[4.5]decane-2-carbonyl)amino]acetyl]phenyl]phenyl]-1H-imidazol-2-yl]pyrrolidin-1-yl]-3-methyl-1-oxobutan-2-yl]carbamate
Database identifiers
- PubChem CID
- 77479228
Properties
Computed structural propertiesFilling in
- XLogP
- 3.6
- Topological polar surface area
- 163 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 11
- Heavy atoms
- 52
- Formal charge
- 0
- Complexity
- 1,290
Related reactions
2 records
Compound notes
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