CS-0566993
(R)-N-(1-(3-(2-Cyano-5-fluorobenzyl)-1-methyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)piperidin-3-yl)-2,2,2-trifluoroacetamide Trelagliptin Impurity
Manufacturer: ChemScene
CAS Number: None
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Purity
98%
MDL No
None
Storage
4°C
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₂₀H₁₉F₄N₅O₃
Molecular Weight
453.39
Synonyms
None
SMILES
FC1=CC(CN2C(N(C(C=C2N3C[C@@H](CCC3)NC(C(F)(F)F)=O)=O)C)=O)=C(C=C1)C#N
Tpsa
100.13
Logp
1.25338
H Acceptors
7
H Donors
1
Rotatable Bonds
4
Other Options
...
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Purity: 98%
MDL No: None
Storage: 4°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₀H₁₉F₄N₅O₃
Molecular Weight: 453.39
Synonyms: None
SMILES: FC1=CC(CN2C(N(C(C=C2N3C[C@@H](CCC3)NC(C(F)(F)F)=O)=O)C)=O)=C(C=C1)C#N
Tpsa: 100.13
Logp: 1.25338
H Acceptors: 7
H Donors: 1
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
4°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₀H₁₉F₄N₅O₃
Molecular Weight:
453.39
Synonyms:
None
SMILES:
FC1=CC(CN2C(N(C(C=C2N3C[C@@H](CCC3)NC(C(F)(F)F)=O)=O)C)=O)=C(C=C1)C#N
Tpsa:
100.13
Logp:
1.25338
H Acceptors:
7
H Donors:
1
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: 4°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₀H₂₂FN₅O₃
Molecular Weight: 399.42
Synonyms: Trelagliptin Impurity 20 HCl
SMILES: O=C(N(C1=O)C)C=C(N2C[C@@H](CCC2)NC(C)=O)N1CC3=C(C=CC(F)=C3)C#N
Tpsa: 100.13
Logp: 0.71098
H Acceptors: 7
H Donors: 1
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
4°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₀H₂₂FN₅O₃
Molecular Weight:
399.42
Synonyms:
Trelagliptin Impurity 20 HCl
SMILES:
O=C(N(C1=O)C)C=C(N2C[C@@H](CCC2)NC(C)=O)N1CC3=C(C=CC(F)=C3)C#N
Tpsa:
100.13
Logp:
0.71098
H Acceptors:
7
H Donors:
1
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: 4°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₁₂FN₃O₃
Molecular Weight: 289.26
Synonyms: Trelagliptin Impurity JYJ
SMILES: N#CC1=CC=C(C=C1CN2C(N(C)C(C=C2OC)=O)=O)F
Tpsa: 77.02
Logp: 0.61468
H Acceptors: 6
H Donors: 0
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
4°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₁₂FN₃O₃
Molecular Weight:
289.26
Synonyms:
Trelagliptin Impurity JYJ
SMILES:
N#CC1=CC=C(C=C1CN2C(N(C)C(C=C2OC)=O)=O)F
Tpsa:
77.02
Logp:
0.61468
H Acceptors:
6
H Donors:
0
Rotatable Bonds:
3
Purity: 98%
MDL No: None
Storage: 4°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₅H₁₄FN₃O₃
Molecular Weight: 303.29
Synonyms: Trelagliptin Impurity YYJ
SMILES: N#CC1=CC=C(C=C1CN2C(N(C)C(C=C2OCC)=O)=O)F
Tpsa: 77.02
Logp: 1.00478
H Acceptors: 6
H Donors: 0
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
4°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₅H₁₄FN₃O₃
Molecular Weight:
303.29
Synonyms:
Trelagliptin Impurity YYJ
SMILES:
N#CC1=CC=C(C=C1CN2C(N(C)C(C=C2OCC)=O)=O)F
Tpsa:
77.02
Logp:
1.00478
H Acceptors:
6
H Donors:
0
Rotatable Bonds:
4