CS-1003789
Epalrestat Impurity 44
Manufacturer: ChemScene
CAS Number: 39486-57-2
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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
C₅H₆N₂O₂S₂
Molecular Weight
190.24
Synonyms
None
SMILES
O=C(N)CN1C(=S)SCC1=O
Tpsa
63.4
Logp
-0.668
H Acceptors
4
H Donors
1
Rotatable Bonds
2
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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: C₅H₆N₂O₂S₂
Molecular Weight: 190.24
Synonyms: None
SMILES: O=C(N)CN1C(=S)SCC1=O
Tpsa: 63.4
Logp: -0.668
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:
C₅H₆N₂O₂S₂
Molecular Weight:
190.24
Synonyms:
None
SMILES:
O=C(N)CN1C(=S)SCC1=O
Tpsa:
63.4
Logp:
-0.668
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: C₂₀H₂₄N₂O₆
Molecular Weight: 388.41
Synonyms: None
SMILES: O=C(OCC)C1=C(NC(=C(C(=O)OC(C)C)C1C=2C=CC=C(C2)N(=O)=O)C)C
Tpsa: 107.77
Logp: 3.3443
H Acceptors: 7
H Donors: 1
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₀H₂₄N₂O₆
Molecular Weight:
388.41
Synonyms:
None
SMILES:
O=C(OCC)C1=C(NC(=C(C(=O)OC(C)C)C1C=2C=CC=C(C2)N(=O)=O)C)C
Tpsa:
107.77
Logp:
3.3443
H Acceptors:
7
H Donors:
1
Rotatable Bonds:
6
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₈H₂₀N₂O₆
Molecular Weight: 360.36
Synonyms: None
SMILES: O=C(OC)C1=C(NC(=C(C(=O)OCC)C1C2=CC=C(C=C2)N(=O)=O)C)C
Tpsa: 107.77
Logp: 2.5657
H Acceptors: 7
H Donors: 1
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₈H₂₀N₂O₆
Molecular Weight:
360.36
Synonyms:
None
SMILES:
O=C(OC)C1=C(NC(=C(C(=O)OCC)C1C2=CC=C(C=C2)N(=O)=O)C)C
Tpsa:
107.77
Logp:
2.5657
H Acceptors:
7
H Donors:
1
Rotatable Bonds:
5
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₁₅NO₄S
Molecular Weight: 221.27
Synonyms: None
SMILES: C(SC[C@@H](C(O)=O)N)CC(OCC)=O
Tpsa: 89.62
Logp: 0.0847
H Acceptors: 5
H Donors: 2
Rotatable Bonds: 7
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₁₅NO₄S
Molecular Weight:
221.27
Synonyms:
None
SMILES:
C(SC[C@@H](C(O)=O)N)CC(OCC)=O
Tpsa:
89.62
Logp:
0.0847
H Acceptors:
5
H Donors:
2
Rotatable Bonds:
7