L-Leucine, N-(4-(4-morpholinylcarbonyl)-2,3,5,6-tetraiodobenzoyl)-
Basic information
- CAS
29820-30-2- Standard SMILES
CC(C)C[C@H](NC(=O)c1c(I)c(I)c(C(=O)N2CCOCC2)c(I)c1I)C(=O)O- InChIKey
KRESJWQYGJMUMA-VIFPVBQESA-N- Molecular formula
- C18H20I4N2O5
- Average molar mass
- 852 g/mol
- Monoisotopic mass
- 851.7551
Names & identifiers
- Preferred name
- L-Leucine, N-(4-(4-morpholinylcarbonyl)-2,3,5,6-tetraiodobenzoyl)-
- IUPAC
- (2S)-4-methyl-2-[[2,3,5,6-tetraiodo-4-(morpholine-4-carbonyl)benzoyl]amino]pentanoic acid
Names & synonyms
BRN 1232895L-Leucine, N-(4-(4-morpholinylcarbonyl)-2,3,5,6-tetraiodobenzoyl)-29820-30-2DTXSID10183959N-(4-(4-Morpholinylcarbonyl)-2,3,5,6-tetraiodobenzoyl)-L-leucine4-(4-((alpha-Carboxy-gamma-methyl-butyl)-carbamoyl)-2,3,5,6-tetrajod-benzoyl)-morpholinRefChem:350777DTXCID00106450N-[2,3,5,6-Tetraiodo-4-(morpholine-4-carbonyl)benzoyl]-L-leucine
Database identifiers
- CAS
29820-30-2- PubChem CID
- 207381
- DTXSID
DTXSID10183959
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 95.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 601
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Compound notes
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