CS-1001811
Linagliptin Impurity 132
Manufacturer: ChemScene
CAS Number: 1620278-39-8
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Purity
98%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₂₅H₂₇N₇O₃
Molecular Weight
473.53
Synonyms
None
SMILES
C(C#CC)N1C2=C(N=C1N3C[C@@H](O)CCC3)N(C)C(=O)N(CC4=NC5=C(C(C)=N4)C=CC=C5)C2=O
Tpsa
111.07
Logp
1.18102
H Acceptors
10
H Donors
1
Rotatable Bonds
4
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 1620278-39-8 | CD-1790 | A2B Chem | -- |
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SAFETY INFORMATION
ghsPictogramUrl
https://dev-s3.chemscene.com/web-image/physicalization/irritant.svg
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
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Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₅H₂₇N₇O₃
Molecular Weight: 473.53
Synonyms: None
SMILES: C(C#CC)N1C2=C(N=C1N3C[C@@H](O)CCC3)N(C)C(=O)N(CC4=NC5=C(C(C)=N4)C=CC=C5)C2=O
Tpsa: 111.07
Logp: 1.18102
H Acceptors: 10
H Donors: 1
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₅H₂₇N₇O₃
Molecular Weight:
473.53
Synonyms:
None
SMILES:
C(C#CC)N1C2=C(N=C1N3C[C@@H](O)CCC3)N(C)C(=O)N(CC4=NC5=C(C(C)=N4)C=CC=C5)C2=O
Tpsa:
111.07
Logp:
1.18102
H Acceptors:
10
H Donors:
1
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₈H₅₃NO₃
Molecular Weight: 451.73
Synonyms: None
SMILES: [C@@H](OC([C@H](CC(C)C)NC=O)=O)(CCCCCCCCCCC)C/C=C\CCCCCC
Tpsa: 55.4
Logp: 7.8965
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 23
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₈H₅₃NO₃
Molecular Weight:
451.73
Synonyms:
None
SMILES:
[C@@H](OC([C@H](CC(C)C)NC=O)=O)(CCCCCCCCCCC)C/C=C\CCCCCC
Tpsa:
55.4
Logp:
7.8965
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
23
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₁₅FN₂O₃
Molecular Weight: 278.28
Synonyms: None
SMILES: O=C(O)C1=CN(C2=CC(NCC)=C(F)C=C2C1=O)CC
Tpsa: 71.33
Logp: 2.2905
H Acceptors: 4
H Donors: 2
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₁₅FN₂O₃
Molecular Weight:
278.28
Synonyms:
None
SMILES:
O=C(O)C1=CN(C2=CC(NCC)=C(F)C=C2C1=O)CC
Tpsa:
71.33
Logp:
2.2905
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₃H₂₇ClO₈
Molecular Weight: 466.91
Synonyms: None
SMILES: C(C1=CC(C([C@@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O)=O)=CC=C1Cl)C2=CC=C(O[C@H]3CCOC3)C=C2
Tpsa: 136.68
Logp: 0.7171
H Acceptors: 8
H Donors: 5
Rotatable Bonds: 10
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₃H₂₇ClO₈
Molecular Weight:
466.91
Synonyms:
None
SMILES:
C(C1=CC(C([C@@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O)=O)=CC=C1Cl)C2=CC=C(O[C@H]3CCOC3)C=C2
Tpsa:
136.68
Logp:
0.7171
H Acceptors:
8
H Donors:
5
Rotatable Bonds:
10