CS-0075189
2-[3-(2H-1,3-Benzodioxol-5-yl)-6-oxo-1,6-dihydropyridazin-1-yl]acetic acid
Manufacturer: ChemScene
CAS Number: 1286722-42-6
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Purity
97%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₃H₁₀N₂O₅
Molecular Weight
274.23
Synonyms
None
SMILES
O=C(C=C1)N(CC(O)=O)N=C1C2=CC(OCO3)=C3C=C2
Tpsa
90.65
Logp
0.7236
H Acceptors
6
H Donors
1
Rotatable Bonds
3
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: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₀N₂O₅
Molecular Weight: 274.23
Synonyms: None
SMILES: O=C(C=C1)N(CC(O)=O)N=C1C2=CC(OCO3)=C3C=C2
Tpsa: 90.65
Logp: 0.7236
H Acceptors: 6
H Donors: 1
Rotatable Bonds: 3
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₀N₂O₅
Molecular Weight:
274.23
Synonyms:
None
SMILES:
O=C(C=C1)N(CC(O)=O)N=C1C2=CC(OCO3)=C3C=C2
Tpsa:
90.65
Logp:
0.7236
H Acceptors:
6
H Donors:
1
Rotatable Bonds:
3
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₃N₃O₃S₂
Molecular Weight: 323.39
Synonyms: None
SMILES: O=C(C1=CC=CS1)NC2=NN=C(SCCCC(O)=O)C=C2
Tpsa: 92.18
Logp: 2.7473
H Acceptors: 6
H Donors: 2
Rotatable Bonds: 7
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₃N₃O₃S₂
Molecular Weight:
323.39
Synonyms:
None
SMILES:
O=C(C1=CC=CS1)NC2=NN=C(SCCCC(O)=O)C=C2
Tpsa:
92.18
Logp:
2.7473
H Acceptors:
6
H Donors:
2
Rotatable Bonds:
7
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₂N₄O₃
Molecular Weight: 248.24
Synonyms: None
SMILES: O=C1NC(N(N=C2)C(C)=C2C(O)=O)=NC(C)=C1C
Tpsa: 100.87
Logp: 0.57906
H Acceptors: 5
H Donors: 2
Rotatable Bonds: 2
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₂N₄O₃
Molecular Weight:
248.24
Synonyms:
None
SMILES:
O=C1NC(N(N=C2)C(C)=C2C(O)=O)=NC(C)=C1C
Tpsa:
100.87
Logp:
0.57906
H Acceptors:
5
H Donors:
2
Rotatable Bonds:
2
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₂₄N₄O₂
Molecular Weight: 280.37
Synonyms: 1-Piperazinecarboxylic acid, 4-[2-(1H-pyrazol-1-yl)ethyl]-, 1,1-dimethylethyl ester
SMILES: O=C(OC(C)(C)C)N1CCN(CCN2N=CC=C2)CC1
Tpsa: 50.6
Logp: 1.4358
H Acceptors: 5
H Donors: 0
Rotatable Bonds: 3
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₂₄N₄O₂
Molecular Weight:
280.37
Synonyms:
1-Piperazinecarboxylic acid, 4-[2-(1H-pyrazol-1-yl)ethyl]-, 1,1-dimethylethyl ester
SMILES:
O=C(OC(C)(C)C)N1CCN(CCN2N=CC=C2)CC1
Tpsa:
50.6
Logp:
1.4358
H Acceptors:
5
H Donors:
0
Rotatable Bonds:
3