CS-1002496
Sacubitril Impurity 44
Manufacturer: ChemScene
CAS Number: 2061992-11-6
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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
C₂₄H₂₇NO₅
Molecular Weight
409.47
Synonyms
None
SMILES
O=C(OCC)C(=CC(NC(=O)CCC(=O)O)CC=1C=CC(=CC1)C=2C=CC=CC2)C
Tpsa
92.7
Logp
3.7551
H Acceptors
4
H Donors
2
Rotatable Bonds
10
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: C₂₄H₂₇NO₅
Molecular Weight: 409.47
Synonyms: None
SMILES: O=C(OCC)C(=CC(NC(=O)CCC(=O)O)CC=1C=CC(=CC1)C=2C=CC=CC2)C
Tpsa: 92.7
Logp: 3.7551
H Acceptors: 4
H Donors: 2
Rotatable Bonds: 10
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₄H₂₇NO₅
Molecular Weight:
409.47
Synonyms:
None
SMILES:
O=C(OCC)C(=CC(NC(=O)CCC(=O)O)CC=1C=CC(=CC1)C=2C=CC=CC2)C
Tpsa:
92.7
Logp:
3.7551
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
10
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₁₁N₃O₆S
Molecular Weight: 265.24
Synonyms: None
SMILES: C(N)(=O)[C@H]1[N@]2C(=O)N(OS(=O)(=O)O)[C@](C2)(CC1)[H]
Tpsa: 130.24
Logp: -1.5253
H Acceptors: 5
H Donors: 2
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:
C₇H₁₁N₃O₆S
Molecular Weight:
265.24
Synonyms:
None
SMILES:
C(N)(=O)[C@H]1[N@]2C(=O)N(OS(=O)(=O)O)[C@](C2)(CC1)[H]
Tpsa:
130.24
Logp:
-1.5253
H Acceptors:
5
H Donors:
2
Rotatable Bonds:
3
Purity: 95%
MDL No: MFCD00044533
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₆O₅S
Molecular Weight: 238.22
Synonyms: None
SMILES: O=C1C=C(S(=O)(O)=O)C2=C(C1=O)C=CC=C2
Tpsa: 88.51
Logp: 0.6807
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 1
Purity:
95%
MDL No:
MFCD00044533
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₆O₅S
Molecular Weight:
238.22
Synonyms:
None
SMILES:
O=C1C=C(S(=O)(O)=O)C2=C(C1=O)C=CC=C2
Tpsa:
88.51
Logp:
0.6807
H Acceptors:
4
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: C₈H₁₂BrNO
Molecular Weight: 218.09
Synonyms: None
SMILES: C[C@H](C1=CC=C(C=C1)O)N.Br
Tpsa: 46.25
Logp: 1.9898
H Acceptors: 2
H Donors: 2
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:
C₈H₁₂BrNO
Molecular Weight:
218.09
Synonyms:
None
SMILES:
C[C@H](C1=CC=C(C=C1)O)N.Br
Tpsa:
46.25
Logp:
1.9898
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
1