At-13148
(1S)-2-amino-1-(4-chlorophenyl)-1-[4-(1H-pyrazol-4-yl)phenyl]ethanol
Molecular Identity
At-13148
(1S)-2-amino-1-(4-chlorophenyl)-1-[4-(1H-pyrazol-4-yl)phenyl]ethanol
PubChem CID: 24905401
2D Structure
Properties
C17H16ClN3O
Molecular Formula
313.80
Molecular Weight
g/mol
313.0982
Exact Mass
Da
2.2
XLogP
Drug-like (Lipinski: < 5)
74.9
TPSA
Good oral absorption (< 140 A²)
3
H-Bond Donors
3
H-Bond Acceptors
354
Complexity
SMILES
Canonical SMILES
SMILES: C1=CC(=CC=C1C2=CNN=C2)C(CN)(C3=CC=C(C=C3)Cl)OIsomeric SMILES
SMILES: C1=CC(=CC=C1C2=CNN=C2)[C@@](CN)(C3=CC=C(C=C3)Cl)OSynonyms(20)
1056901-62-2AT13148AT-13148(S)-1-(4-(1H-Pyrazol-4-yl)phenyl)-2-amino-1-(4-chlorophenyl)ethanolA49037RP1E(+)-(S)-2-Amino-1-(4-chlorophenyl)-1-(4-(1H-pyrazol-4-yl)phenyl)ethanolBenzenemethanol, alpha-(aminomethyl)-alpha-(4-chlorophenyl)-4-(1H-pyrazol-4-yl)-, (alphaS)-(+)-(S)-2-Amino-1-(4-chlorophenyl)-1-[4-(1H-pyrazol-4-yl)phenyl]ethanolRefChem:916440Multi-AGC Kinase Inhibitor AT13148UNII-A49037RP1E(1S)-2-amino-1-(4-chlorophenyl)-1-[4-(1H-pyrazol-4-yl)phenyl]ethanolMFCD25976789AT 13148(1S)-2-Amino-1-(4-chlorophenyl)-1-[4-(1H-pyrazol-4-yl)phenyl]ethan-1-ol
Data from PubChem (NCBI)
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