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Upadacitinib

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Upadacitinib / CAS : 1310726-60-3

Appearance - UN -
HS - DG Class -
Synonyms (3S,4R)-3-Ethyl-4-(3H-Imidazo[1,2-a]Pyrrolo[2,3-e]Pyrazin-8-yl)-N-(2,2,2-Trifluoroethyl)-1-Pyrrolidinecarboxamide; 1-Pyrrolidinecarboxamide, 3-Ethyl-4-(3H-Imidazo[1,2-a]Pyrrolo[2,3-e]Pyrazin-8-yl)-N-(2,2,2-Trifluoroethyl)-, (3S,4R)-; rel-(-)-(3S,4R)-3-Ethyl-4-(3H-Imidazo[1,2-a]Pyrrolo[2,3-e]Pyrazin-8-yl)-N-(2,2,2-Trifluoroethyl)Pyrrolidine-1-Carboxamid
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Properties

Summary

Formula
C17H19F3N6O
Molecular Mass
380.36800
Exact Mass
380.15700
PSA
78.32000
Logp
3.23670
IUPAC
(3S,4R)-3-ethyl-4-(1,5,7,10-tetrazatricyclo[7.3.0.02,6]dodeca-2(6),3,7,9,11-pentaen-12-yl)-N-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide
SMILES
CC[C@@H]1CN(C[C@@H]1C2=CN=C3N2C4=C(NC=C4)N=C3)C(=O)NCC(F)(F)F

Attribute classification

Matter Classification
organic
Category
API & Intermediate > Immune System Medication

Chemical and Physical Properties

Density
1.56±0.1 g/cm3(Predicted)

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