CS-0546306
8-Bromo-7-(2,3-dihydroxypropyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Manufacturer: ChemScene
CAS Number: 111038-24-5
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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
C₁₀H₁₃BrN₄O₄
Molecular Weight
333.14
Synonyms
7-(2,3-Dihydroxypropyl)-8-bromotheophylline
SMILES
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)Br)CC(CO)O
Tpsa
102.28
Logp
-1.4506
H Acceptors
8
H Donors
2
Rotatable Bonds
3
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 111038-24-5 | 1H-Purine-2,6-dione,8-bromo-7-(2,3-dihydroxypropyl)-3,7-dihydro-1,3-dimethyl- | A2B Chem | -- |
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: C₁₀H₁₃BrN₄O₄
Molecular Weight: 333.14
Synonyms: 7-(2,3-Dihydroxypropyl)-8-bromotheophylline
SMILES: CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)Br)CC(CO)O
Tpsa: 102.28
Logp: -1.4506
H Acceptors: 8
H Donors: 2
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:
C₁₀H₁₃BrN₄O₄
Molecular Weight:
333.14
Synonyms:
7-(2,3-Dihydroxypropyl)-8-bromotheophylline
SMILES:
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)Br)CC(CO)O
Tpsa:
102.28
Logp:
-1.4506
H Acceptors:
8
H Donors:
2
Rotatable Bonds:
3
Purity: 98%
MDL No: None
Storage: 4°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₆ClF₃N₄
Molecular Weight: 298.65
Synonyms: 8-Chloro-3-(4-pyridinyl)-6-(trifluoromethyl)[1,2,4]triazolo[4,3-a]pyridine
SMILES: C1=CN=CC=C1C2=NN=C3N2C=C(C=C3Cl)C(F)(F)F
Tpsa: 43.08
Logp: 3.4635
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
4°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₆ClF₃N₄
Molecular Weight:
298.65
Synonyms:
8-Chloro-3-(4-pyridinyl)-6-(trifluoromethyl)[1,2,4]triazolo[4,3-a]pyridine
SMILES:
C1=CN=CC=C1C2=NN=C3N2C=C(C=C3Cl)C(F)(F)F
Tpsa:
43.08
Logp:
3.4635
H Acceptors:
4
H Donors:
0
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: C₁₄H₈Cl₅NO₂
Molecular Weight: 399.48
Synonyms: 2,2,2-TRICHLORO-1-[4-(2,4-DICHLOROBENZOYL)-1-METHYL-1H-PYRROL-2-YL]-1-ETHANONE
SMILES: CN1C=C(C=C1C(=O)C(Cl)(Cl)Cl)C(=O)C2=C(C=C(C=C2)Cl)Cl
Tpsa: 39.07
Logp: 5.1158
H Acceptors: 3
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:
C₁₄H₈Cl₅NO₂
Molecular Weight:
399.48
Synonyms:
2,2,2-TRICHLORO-1-[4-(2,4-DICHLOROBENZOYL)-1-METHYL-1H-PYRROL-2-YL]-1-ETHANONE
SMILES:
CN1C=C(C=C1C(=O)C(Cl)(Cl)Cl)C(=O)C2=C(C=C(C=C2)Cl)Cl
Tpsa:
39.07
Logp:
5.1158
H Acceptors:
3
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: C₁₂H₁₄N₄O₂
Molecular Weight: 246.27
Synonyms: 2-(4-methyl-6-oxo-1,6-dihydropyrimidin-2-yl)-2,3,4,5,6,7-hexahydro-1H-indazol-3-one
SMILES: CC1=CC(=O)NC(=N1)N2C(=O)C3=C(N2)CCCC3
Tpsa: 83.54
Logp: 0.43612
H Acceptors: 4
H Donors: 2
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:
C₁₂H₁₄N₄O₂
Molecular Weight:
246.27
Synonyms:
2-(4-methyl-6-oxo-1,6-dihydropyrimidin-2-yl)-2,3,4,5,6,7-hexahydro-1H-indazol-3-one
SMILES:
CC1=CC(=O)NC(=N1)N2C(=O)C3=C(N2)CCCC3
Tpsa:
83.54
Logp:
0.43612
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
1