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Basic information
- Standard SMILES
CC(C)(C)OC(=O)NN(Cc1ccc(-c2cccc(Cl)c2)cc1)C[C@@H](O)C(=O)O- InChIKey
RCXDIQNUQGVZRG-GOSISDBHSA-N- Molecular formula
- C21H25ClN2O5
- Average molar mass
- 420.9 g/mol
- Monoisotopic mass
- 420.1451996
Names & identifiers
- Preferred name
- (R)-3-[N'-t-Butoxycarbonyl-N-(3'-chlorobiphenyl-4-ylmethyl)-hydrazino]-2-hydroxy-propionic Acid
- IUPAC
- (2R)-3-[[4-(3-chlorophenyl)phenyl]methyl-[(2-methylpropan-2-yl)oxycarbonylamino]amino]-2-hydroxypropanoic acid
Names & synonyms
SCHEMBL9934983RCXDIQNUQGVZRG-GOSISDBHSA-N(R)-3-[N'-t-Butoxycarbonyl-N-(3'-chlorobiphenyl-4-ylmethyl)-hydrazino]-2-hydroxy-propionic Acid
Database identifiers
- PubChem CID
- 67972781
Properties
Computed structural propertiesFilling in
- XLogP
- 1.6
- Topological polar surface area
- 99.1 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 9
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 546
Related reactions
2 records
Compound notes
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