Basic information
- CAS
956777-75-6- Standard SMILES
Cc1c(OC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)ccc2c(-c3ccccc3)cc(=O)oc12- InChIKey
NUZBEOFUJGSFNZ-NRFANRHFSA-N- Molecular formula
- C27H31NO6
- Average molar mass
- 465.5 g/mol
- Monoisotopic mass
- 465.21513771
Names & identifiers
- Preferred name
- N-[(1,1-Dimethylethoxy)carbonyl]-L-leucine 8-methyl-2-oxo-4-phenyl-2H-1-benzopyran-7-yl ester
- IUPAC
- (8-methyl-2-oxo-4-phenylchromen-7-yl) (2S)-4-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate
Names & synonyms
956777-75-6DTXSID701119093AKOS030497649N-[(1,1-Dimethylethoxy)carbonyl]-L-leucine 8-methyl-2-oxo-4-phenyl-2H-1-benzopyran-7-yl ester8-Methyl-2-oxo-4-phenyl-2H-1-benzopyran-7-yl N-(tert-butoxycarbonyl)-L-leucinate(S)-8-methyl-2-oxo-4-phenyl-2H-chromen-7-yl 2-((tert-butoxycarbonyl)amino)-4-methylpentanoate
Database identifiers
- CAS
956777-75-6- PubChem CID
- 1751408
- DTXSID
DTXSID701119093
Properties
Computed structural properties
- XLogP
- 5.7
- Topological polar surface area
- 90.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 9
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 776
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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