CS-0644957
4-(3-(2,5-Dichloro-4,6-dimethylpyridin-3-yl)-1,2,4-oxadiazol-5-yl)-2-methoxyphenol Opicapone impurity
Manufacturer: ChemScene
CAS Number: None
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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
C₁₆H₁₃Cl₂N₃O₃
Molecular Weight
366.20
Synonyms
None
SMILES
COC1=C(C=CC(C2=NC(C3=C(C(Cl)=C(N=C3Cl)C)C)=NO2)=C1)O
Tpsa
81.27
Logp
4.43644
H Acceptors
6
H Donors
1
Rotatable Bonds
3
Other Options
...
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: C₁₆H₁₃Cl₂N₃O₃
Molecular Weight: 366.20
Synonyms: None
SMILES: COC1=C(C=CC(C2=NC(C3=C(C(Cl)=C(N=C3Cl)C)C)=NO2)=C1)O
Tpsa: 81.27
Logp: 4.43644
H Acceptors: 6
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:
C₁₆H₁₃Cl₂N₃O₃
Molecular Weight:
366.20
Synonyms:
None
SMILES:
COC1=C(C=CC(C2=NC(C3=C(C(Cl)=C(N=C3Cl)C)C)=NO2)=C1)O
Tpsa:
81.27
Logp:
4.43644
H Acceptors:
6
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: C₂₃H₃₄N₆O₃
Molecular Weight: 442.55
Synonyms: None
SMILES: CC(C)C1=C2C(N[C@H]3CC[C@@H](N4CCN(CC4)C(CCC(O)=O)=O)CC3)=NC=NN2C=C1
Tpsa: 103.07
Logp: 2.5848
H Acceptors: 7
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:
C₂₃H₃₄N₆O₃
Molecular Weight:
442.55
Synonyms:
None
SMILES:
CC(C)C1=C2C(N[C@H]3CC[C@@H](N4CCN(CC4)C(CCC(O)=O)=O)CC3)=NC=NN2C=C1
Tpsa:
103.07
Logp:
2.5848
H Acceptors:
7
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: C₆H₉NO₃S
Molecular Weight: 175.21
Synonyms: None
SMILES: N#CC1(COS(=O)(C)=O)CC1
Tpsa: 67.16
Logp: 0.26638
H Acceptors: 4
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:
C₆H₉NO₃S
Molecular Weight:
175.21
Synonyms:
None
SMILES:
N#CC1(COS(=O)(C)=O)CC1
Tpsa:
67.16
Logp:
0.26638
H Acceptors:
4
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: C₇H₁₄O₃S
Molecular Weight: 178.25
Synonyms: None
SMILES: CC1(COS(C)(=O)=O)CCC1
Tpsa: 43.37
Logp: 1.1528
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:
C₇H₁₄O₃S
Molecular Weight:
178.25
Synonyms:
None
SMILES:
CC1(COS(C)(=O)=O)CCC1
Tpsa:
43.37
Logp:
1.1528
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
3