Compound Information
Name
SY-5609
SMILES
CC1(C)CC[C@@H](CN1)NC2=NC=C(C(=N2)C3=CNC4=C3C=CC(C#N)=C4P(C)(C)=O)C(F)(F)F
InChIKey
JDJOUBVVSQDIRC-AWEZNQCLSA-N
PubChem CID
146662729
Mass
490.18578 Da
ALogP
3.2119
Molecular Formula
C23H26F3N6OP
2D Structure

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Biotransformations
Reaction Type: Aromatic hydroxylation of fused benzene ring (BTMR1030)
Biosystem: Human
Metabolic Enzyme(s):
×
Reaction Type: Hydroxylation of heteroalicyclic secondary carbon (BTMR1070)
Biosystem: Human
Metabolic Enzyme(s):
×
Reaction Type: Hydroxylation of heteroalicyclic secondary carbon (BTMR1071)
Biosystem: Human
Metabolic Enzyme(s):
×
Reaction Type: N-Dealkylation of secondary arylalkylamine (BTMR1141)
Biosystem: Human
Metabolic Enzyme(s):
×
Reaction Type: Hydroxylation of methyl carbon adjacent to aliphatic ring (BTMR0054)
Biosystem: Human
Metabolic Enzyme(s):
×
Reaction Type: N-Oxidation of pyrimidine (BTMR1115)
Biosystem: Human
Metabolic Enzyme(s):
×