Abbv-cls-484
5-[(7R)-1-fluoro-3-hydroxy-7-(3-methylbutylamino)-5,6,7,8-tetrahydronaphthalen-2-yl]-1,1-dioxo-1,2,5-thiadiazolidin-3-one
Molecular Identity
Abbv-cls-484
5-[(7R)-1-fluoro-3-hydroxy-7-(3-methylbutylamino)-5,6,7,8-tetrahydronaphthalen-2-yl]-1,1-dioxo-1,2,5-thiadiazolidin-3-one
PubChem CID: 155103607
2D Structure
Properties
C17H24FN3O4S
Molecular Formula
385.50
Molecular Weight
g/mol
385.1472
Exact Mass
Da
2.1
XLogP
Drug-like (Lipinski: < 5)
107
TPSA
Good oral absorption (< 140 A²)
3
H-Bond Donors
7
H-Bond Acceptors
624
Complexity
SMILES
Canonical SMILES
SMILES: CC(C)CCNC1CCC2=CC(=C(C(=C2C1)F)N3CC(=O)NS3(=O)=O)OIsomeric SMILES
SMILES: CC(C)CCN[C@@H]1CCC2=CC(=C(C(=C2C1)F)N3CC(=O)NS3(=O)=O)OSynonyms(20)
ABBV-CLS-4842489404-97-782TTG6WR6BAbbv cls 484AC4841,2,5-Thiadiazolidin-3-one, 5-((7R)-1-fluoro-5,6,7,8-tetrahydro-3-hydroxy-7-((3-methylbutyl)amino)-2-naphthalenyl)-, 1,1-dioxide1,2,5-Thiadiazolidin-3-one, 5-[(7R)-1-fluoro-5,6,7,8-tetrahydro-3-hydroxy-7-[(3-methylbutyl)amino]-2-naphthalenyl]-, 1,1-dioxideRefChem:108484OsunprotafibUNII-82TTG6WR6B5-[(3R)-5-FLUORO-7-HYDROXY-3-(ISOPENTYLAMINO)TETRALIN-6-YL]-1,1-DIOXO-1,2,5-THIADIAZOLIDIN-3-ONE5-{(7R)-1-fluoro-3-hydroxy-7-[(3-methylbutyl)amino]-5,6,7,8-tetrahydronaphthalen-2-yl}-1lambda~6~,2,5-thiadiazolidine-1,1,3-trioneosunprotafib [INN]ABBV-CLS-484?orb1688337
Data from PubChem (NCBI)
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