CS-1003044
Baricitinib Impurity 51
Manufacturer: ChemScene
CAS Number: 2402776-80-9
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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
C₁₇H₂₀N₆O₄S
Molecular Weight
404.44
Synonyms
None
SMILES
O=C(OC)CC1(N2N=CC(=C2)C=3N=CN=C4NC=CC43)CN(C1)S(=O)(=O)CC
Tpsa
123.07
Logp
0.7451
H Acceptors
8
H Donors
1
Rotatable Bonds
6
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 2402776-80-9 | Methyl 1-(ethylsulfonyl)-3-[4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1H-pyrazol-1-yl]-3-azetidineacetate | A2B Chem | -- |
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: C₁₇H₂₀N₆O₄S
Molecular Weight: 404.44
Synonyms: None
SMILES: O=C(OC)CC1(N2N=CC(=C2)C=3N=CN=C4NC=CC43)CN(C1)S(=O)(=O)CC
Tpsa: 123.07
Logp: 0.7451
H Acceptors: 8
H Donors: 1
Rotatable Bonds: 6
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₇H₂₀N₆O₄S
Molecular Weight:
404.44
Synonyms:
None
SMILES:
O=C(OC)CC1(N2N=CC(=C2)C=3N=CN=C4NC=CC43)CN(C1)S(=O)(=O)CC
Tpsa:
123.07
Logp:
0.7451
H Acceptors:
8
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: C₁₇H₁₁Cl₃N₆O₃
Molecular Weight: 453.67
Synonyms: None
SMILES: N#CC1=NN(C(=O)NC1=O)C2=CC(Cl)=C(OC3=NN=C(Cl)C(=C3)C(C)C)C(Cl)=C2
Tpsa: 126.55
Logp: 3.45838
H Acceptors: 8
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:
C₁₇H₁₁Cl₃N₆O₃
Molecular Weight:
453.67
Synonyms:
None
SMILES:
N#CC1=NN(C(=O)NC1=O)C2=CC(Cl)=C(OC3=NN=C(Cl)C(=C3)C(C)C)C(Cl)=C2
Tpsa:
126.55
Logp:
3.45838
H Acceptors:
8
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: 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