CS-0536386
1-(2-Fluorobenzyl)-1H-pyrazolo[3,4-b]pyridine-3-carboxylic acid
Manufacturer: ChemScene
CAS Number: 956011-26-0
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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
C₁₄H₁₀FN₃O₂
Molecular Weight
271.25
Synonyms
Riociguat-20
SMILES
C1=CC=C(C(=C1)CN2C3=C(C=CC=N3)C(=N2)C(=O)O)F
Tpsa
68.01
Logp
2.3169
H Acceptors
4
H Donors
1
Rotatable Bonds
3
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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: C₁₄H₁₀FN₃O₂
Molecular Weight: 271.25
Synonyms: Riociguat-20
SMILES: C1=CC=C(C(=C1)CN2C3=C(C=CC=N3)C(=N2)C(=O)O)F
Tpsa: 68.01
Logp: 2.3169
H Acceptors: 4
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:
C₁₄H₁₀FN₃O₂
Molecular Weight:
271.25
Synonyms:
Riociguat-20
SMILES:
C1=CC=C(C(=C1)CN2C3=C(C=CC=N3)C(=N2)C(=O)O)F
Tpsa:
68.01
Logp:
2.3169
H Acceptors:
4
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: C₉H₉BrN₂
Molecular Weight: 225.09
Synonyms: None
SMILES: C1=CC(=CC=C1[C@@H](CC#N)N)Br
Tpsa: 49.81
Logp: 2.36258
H Acceptors: 2
H Donors: 1
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:
C₉H₉BrN₂
Molecular Weight:
225.09
Synonyms:
None
SMILES:
C1=CC(=CC=C1[C@@H](CC#N)N)Br
Tpsa:
49.81
Logp:
2.36258
H Acceptors:
2
H Donors:
1
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: C₉H₉BrN₂
Molecular Weight: 225.09
Synonyms: None
SMILES: C1=CC(=CC=C1[C@H](CC#N)N)Br
Tpsa: 49.81
Logp: 2.36258
H Acceptors: 2
H Donors: 1
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:
C₉H₉BrN₂
Molecular Weight:
225.09
Synonyms:
None
SMILES:
C1=CC(=CC=C1[C@H](CC#N)N)Br
Tpsa:
49.81
Logp:
2.36258
H Acceptors:
2
H Donors:
1
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: C₉H₁₂ClNO₃
Molecular Weight: 217.65
Synonyms: (S)-3-AMINO-3-(3-HYDROXY-PHENYL)-PROPIONIC ACID HYDROCHLORIDE
SMILES: O=C(O)C[C@H](N)C1=CC=CC(O)=C1.[H]Cl
Tpsa: 83.55
Logp: 1.2885
H Acceptors: 3
H Donors: 3
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:
C₉H₁₂ClNO₃
Molecular Weight:
217.65
Synonyms:
(S)-3-AMINO-3-(3-HYDROXY-PHENYL)-PROPIONIC ACID HYDROCHLORIDE
SMILES:
O=C(O)C[C@H](N)C1=CC=CC(O)=C1.[H]Cl
Tpsa:
83.55
Logp:
1.2885
H Acceptors:
3
H Donors:
3
Rotatable Bonds:
3