Rev 6207
Basic information
- CAS
98056-23-6- Standard SMILES
CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N(CC(=O)O)N1CCCC1- InChIKey
KCDAGNQTOFWXBX-WMZOPIPTSA-N- Molecular formula
- C21H31N3O5
- Average molar mass
- 405.5 g/mol
- Monoisotopic mass
- 405.2263711
Overview
structure given in first source
Names & identifiers
- Preferred name
- Rev 6207
- IUPAC
- 2-[[(2S)-2-[[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]amino]propanoyl]-pyrrolidin-1-ylamino]acetic acid
- English name
- REV 6207
- Molecular formula
- C21H31N3O5
- Molecular weight
- 405.49
Names & synonyms
Rev 620798056-23-6Rev-6207Glycine, N-(N-(1-(ethoxycarbonyl)-3-phenylpropyl)-L-alanyl)-N-1-pyrrolidinyl-, (S)-RefChem:179016N-(N-(1-(Ethoxycarbonyl)-3-phenylpropyl)alanyl)-N-(1-pyrrolidinyl)glycine2-[[(2S)-2-[[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]amino]propanoyl]-pyrrolidin-1-ylamino]acetic acidRev 6207 (free base)orb1701699SCHEMBL10970133DTXSID60913485AKOS040747375
Show more names
Glycine, N-[(1S)-1-(ethoxycarbonyl)-3-phenylpropyl]-L-alanyl-N-1-pyrrolidinyl- (9CI)
N-(((S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl)-L-alanyl)-N-(pyrrolidin-1-yl)glycineHY-113748T26067N-(1-Ethoxy-1-oxo-4-phenylbutan-2-yl)alanyl-N-pyrrolidin-1-ylglycineN-(N (1-(ethoxycarbonyl)-3-phenylpropyl)alanyl)-N-(1-pyrrolidinyl)glycineN-[(2S)-1-Ethoxy-1-oxo-4-phenylbutan-2-yl]-L-alanyl-N-(pyrrolidin-1-yl)glycine
Database identifiers
- CAS
98056-23-6- PubChem CID
- 5487040
- DTXSID
DTXSID60913485
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 99.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 12
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 544
Physicochemical properties
- Boiling point
- 577.5 · 577.5±60.0 °C(Predicted)
- Density
- 1.22 · 1.22±0.1 g/cm3(Predicted)
- pka
- 5.44 · 5.44±0.39(Predicted)
Chemistry & industry
Applications
DescriptionRev 6207 is a non-sulfhydryl containing ACE-inhibitor.
UsesRev 6207 (free base) is a potent non-thiol angiotensin I converting enzyme inhibitor. Rev 6207 (free base) has comparable antihypertensive activity to Enalapril (HY-B0331) in awake monkeys with high renin activity and can be used in the study of hypertensive diseases[1].
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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