Elsubrutinib
4-[(3S)-1-prop-2-enoylpiperidin-3-yl]-1H-indole-7-carboxamide
Molecular Identity
Elsubrutinib
4-[(3S)-1-prop-2-enoylpiperidin-3-yl]-1H-indole-7-carboxamide
PubChem CID: 117773770
2D Structure
Properties
C17H19N3O2
Molecular Formula
297.35
Molecular Weight
g/mol
297.1477
Exact Mass
Da
1.6
XLogP
Drug-like (Lipinski: < 5)
79.2
TPSA
Good oral absorption (< 140 A²)
2
H-Bond Donors
2
H-Bond Acceptors
465
Complexity
SMILES
Canonical SMILES
SMILES: C=CC(=O)N1CCCC(C1)C2=C3C=CNC3=C(C=C2)C(=O)NIsomeric SMILES
SMILES: C=CC(=O)N1CCC[C@H](C1)C2=C3C=CNC3=C(C=C2)C(=O)NSynonyms(20)
Elsubrutinib1643570-24-4Elsubrutinib [USAN]Elsubrutinib [INN]ABBV105ABBV-1054-[(3S)-1-prop-2-enoylpiperidin-3-yl]-1H-indole-7-carboxamideUNII-1487U1Q3IQ(S)-4-(1-Acryloylpiperidin-3-yl)-1H-indole-7-carboxamide1487U1Q3IQ1H-Indole-7-carboxamide, 4-((3S)-1-(1-oxo-2-propen-1-yl)-3-piperidinyl)-4-((3S)-1-(PROP-2-ENOYL)-PIPERIDIN-3-YL)-1H-INDOLE-7-CARBOXAMIDE4-((3S)-1-prop-2-enoylpiperidin-3-yl)-1H-indole-7-carboxamideRefChem:136554SCHEMBL16337209
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Elsubrutinib
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