CS-1005441
Difelikefalin Impurity 1
Manufacturer: ChemScene
CAS Number: 956242-62-9
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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
C₂₀H₂₉N₃O₄
Molecular Weight
375.46
Synonyms
None
SMILES
C(N[C@@H](CC1=CC=CC=C1)C(O)=O)(=O)C2CCN(C([C@H](C(C)C)N)=O)CC2
Tpsa
112.73
Logp
1.0204
H Acceptors
4
H Donors
3
Rotatable Bonds
7
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: C₂₀H₂₉N₃O₄
Molecular Weight: 375.46
Synonyms: None
SMILES: C(N[C@@H](CC1=CC=CC=C1)C(O)=O)(=O)C2CCN(C([C@H](C(C)C)N)=O)CC2
Tpsa: 112.73
Logp: 1.0204
H Acceptors: 4
H Donors: 3
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:
C₂₀H₂₉N₃O₄
Molecular Weight:
375.46
Synonyms:
None
SMILES:
C(N[C@@H](CC1=CC=CC=C1)C(O)=O)(=O)C2CCN(C([C@H](C(C)C)N)=O)CC2
Tpsa:
112.73
Logp:
1.0204
H Acceptors:
4
H Donors:
3
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: C₁₀H₁₆N₂O₃
Molecular Weight: 212.25
Synonyms: None
SMILES: O=N(=O)OC12CC3CC(C1)CC(N)(C3)C2
Tpsa: 78.39
Logp: 1.2448
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:
C₁₀H₁₆N₂O₃
Molecular Weight:
212.25
Synonyms:
None
SMILES:
O=N(=O)OC12CC3CC(C1)CC(N)(C3)C2
Tpsa:
78.39
Logp:
1.2448
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: C₂₁H₃₁N₃O₄
Molecular Weight: 389.49
Synonyms: None
SMILES: C([C@H](C(CC)C)N)(=O)N1CCC(C(N[C@@H](CC2=CC=CC=C2)C(O)=O)=O)CC1
Tpsa: 112.73
Logp: 1.4105
H Acceptors: 4
H Donors: 3
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:
C₂₁H₃₁N₃O₄
Molecular Weight:
389.49
Synonyms:
None
SMILES:
C([C@H](C(CC)C)N)(=O)N1CCC(C(N[C@@H](CC2=CC=CC=C2)C(O)=O)=O)CC1
Tpsa:
112.73
Logp:
1.4105
H Acceptors:
4
H Donors:
3
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: C₂₄H₂₉N₃O₄
Molecular Weight: 423.50
Synonyms: None
SMILES: C([C@H](CC1=CC=CC=C1)N)(=O)N2CCC(C(N[C@@H](CC3=CC=CC=C3)C(O)=O)=O)CC2
Tpsa: 112.73
Logp: 1.6071
H Acceptors: 4
H Donors: 3
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:
C₂₄H₂₉N₃O₄
Molecular Weight:
423.50
Synonyms:
None
SMILES:
C([C@H](CC1=CC=CC=C1)N)(=O)N2CCC(C(N[C@@H](CC3=CC=CC=C3)C(O)=O)=O)CC2
Tpsa:
112.73
Logp:
1.6071
H Acceptors:
4
H Donors:
3
Rotatable Bonds:
8