Thyrotropin-releasing hormone, 2-fluoromethylimidazole-
Basic information
- CAS
92484-23-6- Standard SMILES
N[C@@H](Cc1cnc(C(F)(F)F)[nH]1)C(=O)N1CCC[C@H]1C(=O)NC(=O)[C@@H]1CCC(=O)N1- InChIKey
VFWHEXLJERBSPY-DCAQKATOSA-N- Molecular formula
- C17H21F3N6O4
- Average molar mass
- 430.4 g/mol
- Monoisotopic mass
- 430.15763766
Names & identifiers
- Preferred name
- Thyrotropin-releasing hormone, 2-fluoromethylimidazole-
- IUPAC
- (2S)-N-[(2S)-1-[(2S)-2-amino-3-[2-(trifluoromethyl)-1H-imidazol-5-yl]propanoyl]pyrrolidine-2-carbonyl]-5-oxopyrrolidine-2-carboxamide
- English name
- thyrotropin-releasing hormone, 2-fluoromethylimidazole-
- Molecular formula
- C17H21F3N6O4
- Molecular weight
- 430.38
Names & synonyms
2-Tfm-trh2-Trifluoromethyl-Im-trh92484-23-6TRH, 2-fluoromethylimidazole-L-Prolinamide, 5-oxo-L-prolyl-2-(trifluoromethyl)-L-histidyl-, (SP-4-2)-RefChem:189901(2S)-N-[(2S)-1-[(2S)-2-amino-3-[2-(trifluoromethyl)-1H-imidazol-5-yl]propanoyl]pyrrolidine-2-carbonyl]-5-oxopyrrolidine-2-carboxamideDTXSID00919148VFWHEXLJERBSPY-DCAQKATOSA-N2-(Trifluoromethyl)-L-histidyl-N-{hydroxy[(2S)-5-hydroxy-3,4-dihydro-2H-pyrrol-2-yl]methylidene}-L-prolinamide2-(Trifluoromethyl)histidyl-N-[hydroxy(5-hydroxy-3,4-dihydro-2H-pyrrol-2-yl)methylidene]prolinamide5-Oxo-L-Pro-2-(trifluoromethyl)-L-His-L-Pro-NH2
Show more names
thyrotropin-releasing hormone, 2-fluoromethylimidazole-
Database identifiers
- CAS
Properties
Computed structural properties
- XLogP
- -1.6
- Topological polar surface area
- 150 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 5
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 718
Physicochemical properties
- Boiling point
- 898.885 · 898.885±65.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.493 · 1.493±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 10.841 · 10.841±0.10(predicted)
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…