Molecules/(2S)-2-(2,4-difluorophenyl)-1-(1H-1,2,4-triazol-2-ium-2-yl)-3-(1,2,4-triazol-1-yl)propan-2-ol
(2S)-2-(2,4-difluorophenyl)-1-(1H-1,2,4-triazol-2-ium-2-yl)-3-(1,2,4-triazol-1-yl)propan-2-ol
(2S)-2-(2,4-difluorophenyl)-1-(1H-1,2,4-triazol-2-ium-2-yl)-3-(1,2,4-triazol-1-yl)propan-2-ol
Molecular Identity
(2S)-2-(2,4-difluorophenyl)-1-(1H-1,2,4-triazol-2-ium-2-yl)-3-(1,2,4-triazol-1-yl)propan-2-ol
(2S)-2-(2,4-difluorophenyl)-1-(1H-1,2,4-triazol-2-ium-2-yl)-3-(1,2,4-triazol-1-yl)propan-2-ol
PubChem CID: 445283
2D Structure
Properties
C13H13F2N6O+
Molecular Formula
307.28
Molecular Weight
g/mol
307.1119
Exact Mass
Da
1.2
XLogP
Drug-like (Lipinski: < 5)
83.5
TPSA
Good oral absorption (< 140 A²)
2
H-Bond Donors
6
H-Bond Acceptors
378
Complexity
SMILES
Canonical SMILES
SMILES: C1=CC(=C(C=C1F)F)C(CN2C=NC=N2)(C[N+]3=CN=CN3)OIsomeric SMILES
SMILES: C1=CC(=C(C=C1F)F)[C@](CN2C=NC=N2)(C[N+]3=CN=CN3)OSynonyms(2)
TPF(2S)-2-(2,4-difluorophenyl)-1-(1H-1,2,4-triazol-2-ium-2-yl)-3-(1,2,4-triazol-1-yl)propan-2-ol
Data from PubChem (NCBI)
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Molecular Structure
(2S)-2-(2,4-difluorophenyl)-1-(1H-1,2,4-triazol-2-ium-2-yl)-3-(1,2,4-triazol-1-yl)propan-2-ol
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Drug Network
Trials and conditions connected to (2S)-2-(2,4-difluorophenyl)-1-(1H-1,2,4-triazol-2-ium-2-yl)-3-(1,2,4-triazol-1-yl)propan-2-ol
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