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Basic information
- Standard SMILES
CC(C)(C)NC(=O)C1CC(Cl)CN1C(=O)C(O)C(Cc1ccccc1)NC(=O)C(CCS(N)(=O)=O)NC(=O)OCc1ccccc1- InChIKey
CXSDASZTBIROED-UHFFFAOYSA-N- Molecular formula
- C31H42ClN5O8S
- Average molar mass
- 680.2 g/mol
- Monoisotopic mass
- 679.2442622
Names & identifiers
- IUPAC
- benzyl N-[1-[[4-[2-(tert-butylcarbamoyl)-4-chloropyrrolidin-1-yl]-3-hydroxy-4-oxo-1-phenylbutan-2-yl]amino]-1-oxo-4-sulfamoylbutan-2-yl]carbamate
Database identifiers
- PubChem CID
- 19049891
Properties
Computed structural propertiesFilling in
- XLogP
- 1.9
- Topological polar surface area
- 206 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 15
- Heavy atoms
- 46
- Formal charge
- 0
- Complexity
- 1,150
Related reactions
1 records
Compound notes
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