CS-1005032
Edoxaban Impurity 29
Manufacturer: ChemScene
CAS Number: 852291-42-0
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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
C₁₄H₁₇BrN₂O₃S₂
Molecular Weight
405.33
Synonyms
None
SMILES
O=S(=O)(O)C1=CC=C(C=C1)C.BrC1=NC2=C(S1)CN(C)CC2
Tpsa
70.5
Logp
3.13522
H Acceptors
5
H Donors
1
Rotatable Bonds
1
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: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₁₇BrN₂O₃S₂
Molecular Weight: 405.33
Synonyms: None
SMILES: O=S(=O)(O)C1=CC=C(C=C1)C.BrC1=NC2=C(S1)CN(C)CC2
Tpsa: 70.5
Logp: 3.13522
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 1
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₁₇BrN₂O₃S₂
Molecular Weight:
405.33
Synonyms:
None
SMILES:
O=S(=O)(O)C1=CC=C(C=C1)C.BrC1=NC2=C(S1)CN(C)CC2
Tpsa:
70.5
Logp:
3.13522
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: C₆H₁₂N₂O
Molecular Weight: 128.17
Synonyms: None
SMILES: O=C(C=C(NC)C)NC
Tpsa: 41.13
Logp: -0.1444
H Acceptors: 2
H Donors: 2
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:
C₆H₁₂N₂O
Molecular Weight:
128.17
Synonyms:
None
SMILES:
O=C(C=C(NC)C)NC
Tpsa:
41.13
Logp:
-0.1444
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
2
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₁₉ClO₃
Molecular Weight: 222.71
Synonyms: None
SMILES: [C@@H](CCCCC(OCC)=O)(CCCl)O
Tpsa: 46.53
Logp: 2.0997
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 8
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₁₉ClO₃
Molecular Weight:
222.71
Synonyms:
None
SMILES:
[C@@H](CCCCC(OCC)=O)(CCCl)O
Tpsa:
46.53
Logp:
2.0997
H Acceptors:
3
H Donors:
1
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: C₁₃H₁₄N₂O₂
Molecular Weight: 230.26
Synonyms: None
SMILES: O=C1N(N=C(C)C1CC(=O)C)C=2C=CC=CC2
Tpsa: 49.74
Logp: 2.0044
H Acceptors: 3
H Donors: 0
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:
C₁₃H₁₄N₂O₂
Molecular Weight:
230.26
Synonyms:
None
SMILES:
O=C1N(N=C(C)C1CC(=O)C)C=2C=CC=CC2
Tpsa:
49.74
Logp:
2.0044
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
3