CS-1003046
Resmetirom (Mgl-3196) Impurity 33
Manufacturer: ChemScene
CAS Number: 2403724-53-6
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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
C₁₉H₁₇Cl₃N₆O₄
Molecular Weight
499.74
Synonyms
None
SMILES
N#CC(=NNC1=CC(Cl)=C(OC2=NN=C(Cl)C(=C2)C(C)C)C(Cl)=C1)C(=O)NC(=O)OCC
Tpsa
138.59
Logp
4.91668
H Acceptors
9
H Donors
2
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: C₁₉H₁₇Cl₃N₆O₄
Molecular Weight: 499.74
Synonyms: None
SMILES: N#CC(=NNC1=CC(Cl)=C(OC2=NN=C(Cl)C(=C2)C(C)C)C(Cl)=C1)C(=O)NC(=O)OCC
Tpsa: 138.59
Logp: 4.91668
H Acceptors: 9
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:
C₁₉H₁₇Cl₃N₆O₄
Molecular Weight:
499.74
Synonyms:
None
SMILES:
N#CC(=NNC1=CC(Cl)=C(OC2=NN=C(Cl)C(=C2)C(C)C)C(Cl)=C1)C(=O)NC(=O)OCC
Tpsa:
138.59
Logp:
4.91668
H Acceptors:
9
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: C₁₄H₁₅Cl₂N₃O₂
Molecular Weight: 328.19
Synonyms: None
SMILES: ClC=1C=C(N)C=C(Cl)C1OC2=NN=C(OC)C(=C2)C(C)C
Tpsa: 70.26
Logp: 4.2899
H Acceptors: 5
H Donors: 1
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:
C₁₄H₁₅Cl₂N₃O₂
Molecular Weight:
328.19
Synonyms:
None
SMILES:
ClC=1C=C(N)C=C(Cl)C1OC2=NN=C(OC)C(=C2)C(C)C
Tpsa:
70.26
Logp:
4.2899
H Acceptors:
5
H Donors:
1
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: C₁₉H₁₉ClN₆O₂
Molecular Weight: 398.85
Synonyms: None
SMILES: C([C@H](NC(=O)C=1C=C(C(C)O)NN1)C)N2N=C(C=C2)C3=CC(Cl)=C(C#N)C=C3
Tpsa: 119.62
Logp: 2.67008
H Acceptors: 6
H Donors: 3
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:
C₁₉H₁₉ClN₆O₂
Molecular Weight:
398.85
Synonyms:
None
SMILES:
C([C@H](NC(=O)C=1C=C(C(C)O)NN1)C)N2N=C(C=C2)C3=CC(Cl)=C(C#N)C=C3
Tpsa:
119.62
Logp:
2.67008
H Acceptors:
6
H Donors:
3
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: C₁₈H₂₆N₂
Molecular Weight: 270.41
Synonyms: None
SMILES: C(N[C@@H]1C2CCN(C1)CC2)[C@@H]3C=4C(CCC3)=CC=CC4
Tpsa: 15.27
Logp: 2.7903
H Acceptors: 2
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:
C₁₈H₂₆N₂
Molecular Weight:
270.41
Synonyms:
None
SMILES:
C(N[C@@H]1C2CCN(C1)CC2)[C@@H]3C=4C(CCC3)=CC=CC4
Tpsa:
15.27
Logp:
2.7903
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
3