CS-1001395
Alogliptin Impurity 60
Manufacturer: ChemScene
CAS Number: 1430222-06-2
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Purity
≥95%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₄H₁₂ClN₃O₂
Molecular Weight
289.72
Synonyms
None
SMILES
N#CC=1C=CC=CC1CN2C(Cl)=CC(=O)N(C2=O)CC
Tpsa
67.79
Logp
1.60328
H Acceptors
5
H Donors
0
Rotatable Bonds
3
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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: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₁₂ClN₃O₂
Molecular Weight: 289.72
Synonyms: None
SMILES: N#CC=1C=CC=CC1CN2C(Cl)=CC(=O)N(C2=O)CC
Tpsa: 67.79
Logp: 1.60328
H Acceptors: 5
H Donors: 0
Rotatable Bonds: 3
Purity:
≥95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₁₂ClN₃O₂
Molecular Weight:
289.72
Synonyms:
None
SMILES:
N#CC=1C=CC=CC1CN2C(Cl)=CC(=O)N(C2=O)CC
Tpsa:
67.79
Logp:
1.60328
H Acceptors:
5
H Donors:
0
Rotatable Bonds:
3
Purity: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₆H₂₃N₅O₄
Molecular Weight: 469.49
Synonyms: None
SMILES: O=C1N(C(=O)C=2C1=CC=CC2)[C@H]3CN(CCC3)C=4N(CC5=C(C#N)C=CC=C5)C(=O)N(C)C(=O)C4
Tpsa: 108.41
Logp: 1.73198
H Acceptors: 8
H Donors: 0
Rotatable Bonds: 4
Purity:
≥95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₆H₂₃N₅O₄
Molecular Weight:
469.49
Synonyms:
None
SMILES:
O=C1N(C(=O)C=2C1=CC=CC2)[C@H]3CN(CCC3)C=4N(CC5=C(C#N)C=CC=C5)C(=O)N(C)C(=O)C4
Tpsa:
108.41
Logp:
1.73198
H Acceptors:
8
H Donors:
0
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: C₁₆H₁₈FN₃O₂
Molecular Weight: 303.33
Synonyms: None
SMILES: O=C1C=2C3=C(C(=C(F)C2)N4CCNCC4)OC[C@H](C)N3C=C1
Tpsa: 46.5
Logp: 1.5036
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₁₈FN₃O₂
Molecular Weight:
303.33
Synonyms:
None
SMILES:
O=C1C=2C3=C(C(=C(F)C2)N4CCNCC4)OC[C@H](C)N3C=C1
Tpsa:
46.5
Logp:
1.5036
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
1
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₅NO₃
Molecular Weight: 209.24
Synonyms: None
SMILES: O=C1C=CC(=CC1=O)C(O)CNC(C)C
Tpsa: 66.4
Logp: -0.0203
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:
C₁₁H₁₅NO₃
Molecular Weight:
209.24
Synonyms:
None
SMILES:
O=C1C=CC(=CC1=O)C(O)CNC(C)C
Tpsa:
66.4
Logp:
-0.0203
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
4