CS-0644819
(Z)-5-Chloro-N'-hydroxy-2-(hydroxyamino)-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
C₈H₁₁ClN₄O₂
Molecular Weight
230.65
Synonyms
None
SMILES
CC1=C(C(C)=C(C(NO)=N1)/C(N)=N/O)Cl
Tpsa
103.76
Logp
1.24744
H Acceptors
5
H Donors
4
Rotatable Bonds
2
Other Options
...
SAFETY INFORMATION
ghsPictogramUrl
https://dev-s3.chemscene.com/web-image/physicalization/irritant.svg
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: C₈H₁₁ClN₄O₂
Molecular Weight: 230.65
Synonyms: None
SMILES: CC1=C(C(C)=C(C(NO)=N1)/C(N)=N/O)Cl
Tpsa: 103.76
Logp: 1.24744
H Acceptors: 5
H Donors: 4
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:
C₈H₁₁ClN₄O₂
Molecular Weight:
230.65
Synonyms:
None
SMILES:
CC1=C(C(C)=C(C(NO)=N1)/C(N)=N/O)Cl
Tpsa:
103.76
Logp:
1.24744
H Acceptors:
5
H Donors:
4
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: C₁₆H₁₄Cl₂N₄O₆
Molecular Weight: 429.21
Synonyms: None
SMILES: COC1=C(C([N+]([O-])=O)=CC(C(N/C(C2=C(C(Cl)=C(N=C2Cl)C)C)=N\O)=O)=C1)O
Tpsa: 147.18
Logp: 3.19344
H Acceptors: 8
H Donors: 3
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:
C₁₆H₁₄Cl₂N₄O₆
Molecular Weight:
429.21
Synonyms:
None
SMILES:
COC1=C(C([N+]([O-])=O)=CC(C(N/C(C2=C(C(Cl)=C(N=C2Cl)C)C)=N\O)=O)=C1)O
Tpsa:
147.18
Logp:
3.19344
H Acceptors:
8
H Donors:
3
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: C₂₃H₁₇Cl₂N₅O₁₁
Molecular Weight: 610.31
Synonyms: None
SMILES: COC1=CC(C(N/C(C2=C(C(Cl)=CN=C2Cl)C)=N\OC(C3=CC([N+]([O-])=O)=C(C(OC)=C3)O)=O)=O)=CC([N+]([O-])=O)=C1O
Tpsa: 225.85
Logp: 3.89022
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:
C₂₃H₁₇Cl₂N₅O₁₁
Molecular Weight:
610.31
Synonyms:
None
SMILES:
COC1=CC(C(N/C(C2=C(C(Cl)=CN=C2Cl)C)=N\OC(C3=CC([N+]([O-])=O)=C(C(OC)=C3)O)=O)=O)=CC([N+]([O-])=O)=C1O
Tpsa:
225.85
Logp:
3.89022
H Acceptors:
13
H Donors:
3
Rotatable Bonds:
8
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₅H₁₁NO₃S
Molecular Weight: 285.32
Synonyms: None
SMILES: O=C(C(N1SC2=C(C1=O)C=CC=C2)C3=CC=CC=C3)O
Tpsa: 59.3
Logp: 2.737
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 3
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₅H₁₁NO₃S
Molecular Weight:
285.32
Synonyms:
None
SMILES:
O=C(C(N1SC2=C(C1=O)C=CC=C2)C3=CC=CC=C3)O
Tpsa:
59.3
Logp:
2.737
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
3