CS-1002684
Saxagliptin Impurity 34
Manufacturer: ChemScene
CAS Number: 2173146-34-2
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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
C₁₈H₂₃N₃O₂
Molecular Weight
313.39
Synonyms
None
SMILES
[C@H](C(=O)N1[C@@]2([C@@](C2)(C[C@H]1C#N)[H])[H])(N)C34CC5C(=O)C(C3)CC(C4)C5
Tpsa
87.19
Logp
1.22208
H Acceptors
4
H Donors
1
Rotatable Bonds
2
SAFETY INFORMATION
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: C₁₈H₂₃N₃O₂
Molecular Weight: 313.39
Synonyms: None
SMILES: [C@H](C(=O)N1[C@@]2([C@@](C2)(C[C@H]1C#N)[H])[H])(N)C34CC5C(=O)C(C3)CC(C4)C5
Tpsa: 87.19
Logp: 1.22208
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₈H₂₃N₃O₂
Molecular Weight:
313.39
Synonyms:
None
SMILES:
[C@H](C(=O)N1[C@@]2([C@@](C2)(C[C@H]1C#N)[H])[H])(N)C34CC5C(=O)C(C3)CC(C4)C5
Tpsa:
87.19
Logp:
1.22208
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
2
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₁H₂₂ClNO₂S₂
Molecular Weight: 419.99
Synonyms: None
SMILES: O=C(OC)C(C=1C=CC=CC1Cl)N(CCC=2SC=CC2)CCC=3SC=CC3
Tpsa: 29.54
Logp: 5.4645
H Acceptors: 5
H Donors: 0
Rotatable Bonds: 9
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₁H₂₂ClNO₂S₂
Molecular Weight:
419.99
Synonyms:
None
SMILES:
O=C(OC)C(C=1C=CC=CC1Cl)N(CCC=2SC=CC2)CCC=3SC=CC3
Tpsa:
29.54
Logp:
5.4645
H Acceptors:
5
H Donors:
0
Rotatable Bonds:
9
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₁H₂₃Cl₂NO₂S₂
Molecular Weight: 456.45
Synonyms: None
SMILES: Cl.O=C(OC)C(C=1C=CC=CC1Cl)N(CCC=2SC=CC2)CCC=3SC=CC3
Tpsa: 29.54
Logp: 5.8863
H Acceptors: 5
H Donors: 0
Rotatable Bonds: 9
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₁H₂₃Cl₂NO₂S₂
Molecular Weight:
456.45
Synonyms:
None
SMILES:
Cl.O=C(OC)C(C=1C=CC=CC1Cl)N(CCC=2SC=CC2)CCC=3SC=CC3
Tpsa:
29.54
Logp:
5.8863
H Acceptors:
5
H Donors:
0
Rotatable Bonds:
9
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₃H₂₉ClO₇
Molecular Weight: 452.93
Synonyms: None
SMILES: O(CC)[C@]1(O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)C2=CC(CC3=CC=C(OCC)C=C3)=C(Cl)C=C2
Tpsa: 108.61
Logp: 1.9926
H Acceptors: 7
H Donors: 4
Rotatable Bonds: 8
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₃H₂₉ClO₇
Molecular Weight:
452.93
Synonyms:
None
SMILES:
O(CC)[C@]1(O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)C2=CC(CC3=CC=C(OCC)C=C3)=C(Cl)C=C2
Tpsa:
108.61
Logp:
1.9926
H Acceptors:
7
H Donors:
4
Rotatable Bonds:
8