CS-1000889
Lifitegrast Impurity 49
Manufacturer: ChemScene
CAS Number: 1270324-69-0
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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
C₁₀H₁₃NO₄S
Molecular Weight
243.28
Synonyms
None
SMILES
O=C(O)C(N)CC1=CC=CC(=C1)S(=O)(=O)C
Tpsa
97.46
Logp
0.0445
H Acceptors
4
H Donors
2
Rotatable Bonds
4
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: C₁₀H₁₃NO₄S
Molecular Weight: 243.28
Synonyms: None
SMILES: O=C(O)C(N)CC1=CC=CC(=C1)S(=O)(=O)C
Tpsa: 97.46
Logp: 0.0445
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:
C₁₀H₁₃NO₄S
Molecular Weight:
243.28
Synonyms:
None
SMILES:
O=C(O)C(N)CC1=CC=CC(=C1)S(=O)(=O)C
Tpsa:
97.46
Logp:
0.0445
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: C₁₈H₁₉FN₂O₄
Molecular Weight: 346.35
Synonyms: None
SMILES: O=C1C=2C3=C(C(=C(F)C2)C4(N)CC4)OC[C@H](C)N3C=C1C(OCC)=O
Tpsa: 83.55
Logp: 2.2185
H Acceptors: 6
H Donors: 1
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₈H₁₉FN₂O₄
Molecular Weight:
346.35
Synonyms:
None
SMILES:
O=C1C=2C3=C(C(=C(F)C2)C4(N)CC4)OC[C@H](C)N3C=C1C(OCC)=O
Tpsa:
83.55
Logp:
2.2185
H Acceptors:
6
H Donors:
1
Rotatable Bonds:
3
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₉N₃O₃S
Molecular Weight: 285.36
Synonyms: None
SMILES: O=S(=O)(N)C1=CC=C(NCC2CCOCC2)C(N)=C1
Tpsa: 107.44
Logp: 0.7547
H Acceptors: 5
H Donors: 3
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:
C₁₂H₁₉N₃O₃S
Molecular Weight:
285.36
Synonyms:
None
SMILES:
O=S(=O)(N)C1=CC=C(NCC2CCOCC2)C(N)=C1
Tpsa:
107.44
Logp:
0.7547
H Acceptors:
5
H Donors:
3
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: C₃₁H₄₆O₂
Molecular Weight: 450.70
Synonyms: None
SMILES: O=C1C=2C=CC=CC2C(=O)C(=C1C=CC(C)CCCC(C)CCCC(C)CCCC(C)C)C
Tpsa: 34.14
Logp: 9.0135
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 14
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₁H₄₆O₂
Molecular Weight:
450.70
Synonyms:
None
SMILES:
O=C1C=2C=CC=CC2C(=O)C(=C1C=CC(C)CCCC(C)CCCC(C)CCCC(C)C)C
Tpsa:
34.14
Logp:
9.0135
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
14