CS-0335721
2-(4-Benzyl-2,3-dioxopiperazin-1-yl)acetic acid
Manufacturer: ChemScene
CAS Number: 1011416-15-1
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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
C₁₃H₁₄N₂O₄
Molecular Weight
262.26
Synonyms
None
SMILES
C1=CC=C(C=C1)CN2CCN(CC(=O)O)C(=O)C2=O
Tpsa
77.92
Logp
-0.058
H Acceptors
3
H Donors
1
Rotatable Bonds
4
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 1011416-15-1 | 2-(4-benzyl-2,3-dioxopiperazin-1-yl)acetic acid | A2B Chem | -- |
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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: C₁₃H₁₄N₂O₄
Molecular Weight: 262.26
Synonyms: None
SMILES: C1=CC=C(C=C1)CN2CCN(CC(=O)O)C(=O)C2=O
Tpsa: 77.92
Logp: -0.058
H Acceptors: 3
H Donors: 1
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:
C₁₃H₁₄N₂O₄
Molecular Weight:
262.26
Synonyms:
None
SMILES:
C1=CC=C(C=C1)CN2CCN(CC(=O)O)C(=O)C2=O
Tpsa:
77.92
Logp:
-0.058
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
4
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₅F₂N₃O₂
Molecular Weight: 283.27
Synonyms: ethyl [4-(difluoromethyl)-3,6-dimethyl-1H-pyrazolo[3,4-b]pyridin-1-yl]acetate
SMILES: CCOC(=O)CN1C2=NC(=CC(=C2C(=N1)C)C(F)F)C
Tpsa: 57.01
Logp: 2.54884
H Acceptors: 5
H Donors: 0
Rotatable Bonds: 4
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₅F₂N₃O₂
Molecular Weight:
283.27
Synonyms:
ethyl [4-(difluoromethyl)-3,6-dimethyl-1H-pyrazolo[3,4-b]pyridin-1-yl]acetate
SMILES:
CCOC(=O)CN1C2=NC(=CC(=C2C(=N1)C)C(F)F)C
Tpsa:
57.01
Logp:
2.54884
H Acceptors:
5
H Donors:
0
Rotatable Bonds:
4
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₆H₁₅F₂N₃O₃
Molecular Weight: 335.31
Synonyms: ethyl [4-(difluoromethyl)-6-(2-furyl)-3-methyl-1H-pyrazolo[3,4-b]pyridin-1-yl]acetate
SMILES: CCOC(=O)CN1C2=C(C(=N1)C)C(=CC(=N2)C3=CC=CO3)C(F)F
Tpsa: 70.15
Logp: 3.50042
H Acceptors: 6
H Donors: 0
Rotatable Bonds: 5
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₁₅F₂N₃O₃
Molecular Weight:
335.31
Synonyms:
ethyl [4-(difluoromethyl)-6-(2-furyl)-3-methyl-1H-pyrazolo[3,4-b]pyridin-1-yl]acetate
SMILES:
CCOC(=O)CN1C2=C(C(=N1)C)C(=CC(=N2)C3=CC=CO3)C(F)F
Tpsa:
70.15
Logp:
3.50042
H Acceptors:
6
H Donors:
0
Rotatable Bonds:
5
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₉H₁₉F₂N₃O₃
Molecular Weight: 375.37
Synonyms: ethyl [4-(difluoromethyl)-6-(3-methoxyphenyl)-3-methyl-1H-pyrazolo[3,4-b]pyridin-1-yl]acetate
SMILES: CCOC(=O)CN1C2=C(C(=N1)C)C(=CC(=N2)C3=CC(=CC=C3)OC)C(F)F
Tpsa: 66.24
Logp: 3.91602
H Acceptors: 6
H Donors: 0
Rotatable Bonds: 6
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₉H₁₉F₂N₃O₃
Molecular Weight:
375.37
Synonyms:
ethyl [4-(difluoromethyl)-6-(3-methoxyphenyl)-3-methyl-1H-pyrazolo[3,4-b]pyridin-1-yl]acetate
SMILES:
CCOC(=O)CN1C2=C(C(=N1)C)C(=CC(=N2)C3=CC(=CC=C3)OC)C(F)F
Tpsa:
66.24
Logp:
3.91602
H Acceptors:
6
H Donors:
0
Rotatable Bonds:
6