Products 3039925-73-7
CAS 3039925-73-7 is the registry number for OT-R agonist 1 (TFA). Offered by: MedChemExpress. Available pack sizes: Get quote.
(2S,4R)-4-[(3,5-dihydroxyphenyl)methoxy]-2-(dimethylcarbamothioyl)-N-[[2-methyl-4-(1-methyl-4,10-dihydropyrazolo[4,5-c][1,5]benzodiazepine-5-carbonyl)phenyl]methyl]pyrrolidine-1-carboxamide;2,2,2-trifluoroacetic acid (CAS 3039925-73-7) is a chemical compound with the molecular formula C37H40F3N7O7S and a molecular weight of 783.8 g/mol. IUPAC name: (2S,4R)-4-[(3,5-dihydroxyphenyl)methoxy]-2-(dimethylcarbamothioyl)-N-[[2-methyl-4-(1-methyl-4,10-dihydropyrazolo[4,5-c][1,5]benzodiazepine-5-carbonyl)phenyl]methyl]pyrrolidine-1-carboxamide;2,2,2-trifluoroacetic acid. InChIKey: LMMHRYYJYFKDSK-GAGCMDAMSA-N.
| Molecular formula | C37H40F3N7O7S |
|---|---|
| Molecular weight | 783.8 g/mol |
| IUPAC name | (2S,4R)-4-[(3,5-dihydroxyphenyl)methoxy]-2-(dimethylcarbamothioyl)-N-[[2-methyl-4-(1-methyl-4,10-dihydropyrazolo[4,5-c][1,5]benzodiazepine-5-carbonyl)phenyl]methyl]pyrrolidine-1-carboxamide;2,2,2-trifluoroacetic acid |
| InChIKey | LMMHRYYJYFKDSK-GAGCMDAMSA-N |
| SMILES | CC1=C(C=CC(=C1)C(=O)N2CC3=C(NC4=CC=CC=C42)N(N=C3)C)CNC(=O)N5C[C@@H](C[C@H]5C(=S)N(C)C)OCC6=CC(=CC(=C6)O)O.C(=O)(C(F)(F)F)O |
Computed by PubChem (NCBI)
Synonyms:
orb3027495