CS-0803087
1-(1,1-Dioxidotetrahydrothiophen-3-yl)-3-methyl-1H-pyrazolo[3,4-b]pyridine-5-carboxylic acid
Manufacturer: ChemScene
CAS Number: 954262-39-6
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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
C₁₂H₁₃N₃O₄S
Molecular Weight
295.31
Synonyms
None
SMILES
OC(=O)C1C=C2C(=NC=1)N(N=C2C)C3CS(=O)(=O)CC3
Tpsa
102.15
Logp
0.79752
H Acceptors
6
H Donors
1
Rotatable Bonds
2
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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: C₁₂H₁₃N₃O₄S
Molecular Weight: 295.31
Synonyms: None
SMILES: OC(=O)C1C=C2C(=NC=1)N(N=C2C)C3CS(=O)(=O)CC3
Tpsa: 102.15
Logp: 0.79752
H Acceptors: 6
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:
C₁₂H₁₃N₃O₄S
Molecular Weight:
295.31
Synonyms:
None
SMILES:
OC(=O)C1C=C2C(=NC=1)N(N=C2C)C3CS(=O)(=O)CC3
Tpsa:
102.15
Logp:
0.79752
H Acceptors:
6
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: C₁₉H₂₉N₃O₄
Molecular Weight: 363.45
Synonyms: None
SMILES: COC(=O)C1=NC=C(C=C1)N2[C@H](C)CN(C(=O)OC(C)(C)C)[C@@H](CC)C2
Tpsa: 71.97
Logp: 3.0924
H Acceptors: 6
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:
C₁₉H₂₉N₃O₄
Molecular Weight:
363.45
Synonyms:
None
SMILES:
COC(=O)C1=NC=C(C=C1)N2[C@H](C)CN(C(=O)OC(C)(C)C)[C@@H](CC)C2
Tpsa:
71.97
Logp:
3.0924
H Acceptors:
6
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: C₁₁H₁₃N₃O₂S
Molecular Weight: 251.30
Synonyms: None
SMILES: NC1C=C2N(N=CC2=CC=1)C3CS(=O)(=O)CC3
Tpsa: 77.98
Logp: 0.9781
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₃N₃O₂S
Molecular Weight:
251.30
Synonyms:
None
SMILES:
NC1C=C2N(N=CC2=CC=1)C3CS(=O)(=O)CC3
Tpsa:
77.98
Logp:
0.9781
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
1
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₀H₂₉ClN₂O₄
Molecular Weight: 396.91
Synonyms: None
SMILES: COC(=O)CC1=C(C=C(Cl)C=C1)CN2C[C@H](C)N(CC2)C(=O)OC(C)(C)C
Tpsa: 59.08
Logp: 3.4967
H Acceptors: 5
H Donors: 0
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:
C₂₀H₂₉ClN₂O₄
Molecular Weight:
396.91
Synonyms:
None
SMILES:
COC(=O)CC1=C(C=C(Cl)C=C1)CN2C[C@H](C)N(CC2)C(=O)OC(C)(C)C
Tpsa:
59.08
Logp:
3.4967
H Acceptors:
5
H Donors:
0
Rotatable Bonds:
4