4,4-Difluoro-N-[(1S)-3-[(1S,5R)-3-(3-Methyl-5-Propan-2-Yl-1,2,4-Triazol-4-Yl)-8-Azabicyclo[3.2.1]Oct-8-Yl]-1-Phenyl-Propyl]Cyclohexane-1-Carboxamide
[CAS# 674782-29-7]

Identification

• Name: 4,4-Difluoro-N-[(1S)-3-[(1S,5R)-3-(3-Methyl-5-Propan-2-Yl-1,2,4-Triazol-4-Yl)-8-Azabicyclo[3.2.1]Oct-8-Yl]-1-Phenyl-Propyl]Cyclohexane-1-Carboxamide
• Synonyms: 4,4-Difluoro-N-[(1S)-3-[(1R,5S)-3-(3-Isopropyl-5-Methyl-1,2,4-Triazol-4-Yl)-8-Azabicyclo[3.2.1]Octan-8-Yl]-1-Phenyl-Propyl]Cyclohexane-1-Carboxamide; 4,4-Difluoro-N-[(1S)-3-[(1R,5S)-3-(3-Isopropyl-5-Methyl-1,2,4-Triazol-4-Yl)-8-Azabicyclo[3.2.1]Octan-8-Yl]-1-Phenylpropyl]-1-Cyclohexanecarboxamide; 4,4-Difluoro-N-[(1S)-3-[(1R,5S)-3-(3-Methyl-5-Propan-2-Yl-1,2,4-Triazol-4-Yl)-8-Azabicyclo[3.2.1]Octan-8-Yl]-1-Phenyl-Propyl]Cyclohexane-1-Carboxamide
• Molecular Formula: C₂₉H₄₁F₂N₅O
• Molecular Weight: 513.67
• CAS Registry Number: 674782-29-7
• SMILES: C2([N]1C(=NN=C1C)C(C)C)C[C@@H]3N([C@H](C2)CC3)CC[C@H](NC(=O)C4CCC(F)(F)CC4)C5=CC=CC=C5
• InChI: 1S/C29H41F2N5O/c1-19(2)27-34-33-20(3)36(27)25-17-23-9-10-24(18-25)35(23)16-13-26(21-7-5-4-6-8-21)32-28(37)22-11-14-29(30,31)15-12-22/h4-8,19,22-26H,9-18H2,1-3H3,(H,32,37)/t23-,24+,25-,26-/m0/s1
• InChIKey: GSNHKUDZZFZSJB-QYOOZWMWSA-N

Properties

• Density: 1.291g/cm³ (Cal.)