CS-0644953
(Z)-2,5-Dichloro-N'-((4-hydroxy-3-methoxy-5-nitrobenzoyl)oxy)-4,6-dimethylnicotinimidamide 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
C₁₆H₁₄Cl₂N₄O₆
Molecular Weight
429.21
Synonyms
None
SMILES
COC1=CC(C(O/N=C(C2=C(N=C(C(Cl)=C2C)C)Cl)\N)=O)=CC([N+]([O-])=O)=C1O
Tpsa
150.17
Logp
3.10494
H Acceptors
8
H Donors
2
Rotatable Bonds
5
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: C₁₆H₁₄Cl₂N₄O₆
Molecular Weight: 429.21
Synonyms: None
SMILES: COC1=CC(C(O/N=C(C2=C(N=C(C(Cl)=C2C)C)Cl)\N)=O)=CC([N+]([O-])=O)=C1O
Tpsa: 150.17
Logp: 3.10494
H Acceptors: 8
H Donors: 2
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₁₄Cl₂N₄O₆
Molecular Weight:
429.21
Synonyms:
None
SMILES:
COC1=CC(C(O/N=C(C2=C(N=C(C(Cl)=C2C)C)Cl)\N)=O)=CC([N+]([O-])=O)=C1O
Tpsa:
150.17
Logp:
3.10494
H Acceptors:
8
H Donors:
2
Rotatable Bonds:
5
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₄H₁₉Cl₂N₅O₁₁
Molecular Weight: 624.34
Synonyms: None
SMILES: COC1=CC(C(N/C(C2=C(C(Cl)=C(N=C2Cl)C)C)=N\OC(C3=CC([N+]([O-])=O)=C(C(OC)=C3)O)=O)=O)=CC([N+]([O-])=O)=C1O
Tpsa: 225.85
Logp: 4.19864
H Acceptors: 13
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:
C₂₄H₁₉Cl₂N₅O₁₁
Molecular Weight:
624.34
Synonyms:
None
SMILES:
COC1=CC(C(N/C(C2=C(C(Cl)=C(N=C2Cl)C)C)=N\OC(C3=CC([N+]([O-])=O)=C(C(OC)=C3)O)=O)=O)=CC([N+]([O-])=O)=C1O
Tpsa:
225.85
Logp:
4.19864
H Acceptors:
13
H Donors:
3
Rotatable Bonds:
8
Purity: 98%
MDL No: None
Storage: 4°C, protect from light
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₁₀N₂O₂S
Molecular Weight: 186.23
Synonyms: None
SMILES: O=C(C1=CSC(CCN)=N1)OC
Tpsa: 65.21
Logp: 0.4309
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
4°C, protect from light
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₁₀N₂O₂S
Molecular Weight:
186.23
Synonyms:
None
SMILES:
O=C(C1=CSC(CCN)=N1)OC
Tpsa:
65.21
Logp:
0.4309
H Acceptors:
5
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:
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