CS-0087902
CCT367766
Manufacturer: ChemScene
CAS Number: 2229856-58-8
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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
C₄₉H₄₈ClN₇O₁₁
Molecular Weight
946.40
Synonyms
None
SMILES
O=C(C1=CC=C2N=C(CN3CCN(CCOCCOCCOC4=CC=CC(C(N5C(CC6)C(NC6=O)=O)=O)=C4C5=O)CC3)C=CC2=C1)NC7=CC(NC(C8=CC=C(OCCO9)C9=C8)=O)=CC=C7Cl
Tpsa
207.27
Logp
4.795
H Acceptors
14
H Donors
3
Rotatable Bonds
17
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: C₄₉H₄₈ClN₇O₁₁
Molecular Weight: 946.40
Synonyms: None
SMILES: O=C(C1=CC=C2N=C(CN3CCN(CCOCCOCCOC4=CC=CC(C(N5C(CC6)C(NC6=O)=O)=O)=C4C5=O)CC3)C=CC2=C1)NC7=CC(NC(C8=CC=C(OCCO9)C9=C8)=O)=CC=C7Cl
Tpsa: 207.27
Logp: 4.795
H Acceptors: 14
H Donors: 3
Rotatable Bonds: 17
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₄₉H₄₈ClN₇O₁₁
Molecular Weight:
946.40
Synonyms:
None
SMILES:
O=C(C1=CC=C2N=C(CN3CCN(CCOCCOCCOC4=CC=CC(C(N5C(CC6)C(NC6=O)=O)=O)=C4C5=O)CC3)C=CC2=C1)NC7=CC(NC(C8=CC=C(OCCO9)C9=C8)=O)=CC=C7Cl
Tpsa:
207.27
Logp:
4.795
H Acceptors:
14
H Donors:
3
Rotatable Bonds:
17
Purity: 98%
MDL No: MFCD16660275
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₉BF₃NO₂S
Molecular Weight: 251.03
Synonyms: 2-Ethylthio-5-trifluoromethylpyridine-3-boronic acid
SMILES: OB(C1=CC(C(F)(F)F)=CN=C1SCC)O
Tpsa: 53.35
Logp: 0.8922
H Acceptors: 4
H Donors: 2
Rotatable Bonds: 3
Purity:
98%
MDL No:
MFCD16660275
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₉BF₃NO₂S
Molecular Weight:
251.03
Synonyms:
2-Ethylthio-5-trifluoromethylpyridine-3-boronic acid
SMILES:
OB(C1=CC(C(F)(F)F)=CN=C1SCC)O
Tpsa:
53.35
Logp:
0.8922
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
3
Purity: 98%
MDL No: MFCD11855905
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₅BrF₃NO
Molecular Weight: 292.05
Synonyms: None
SMILES: FC(F)(F)OC1=C2C=CC=NC2=C(Br)C=C1
Tpsa: 22.12
Logp: 3.8959
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 1
Purity:
98%
MDL No:
MFCD11855905
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₅BrF₃NO
Molecular Weight:
292.05
Synonyms:
None
SMILES:
FC(F)(F)OC1=C2C=CC=NC2=C(Br)C=C1
Tpsa:
22.12
Logp:
3.8959
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
1
Purity: 97%
MDL No: MFCD19707623
Storage: 4°C, protect from light
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₈N₄
Molecular Weight: 148.17
Synonyms: 3-Methyl[1,2,4]triazolo[4,3-a]pyridin-7-amine
SMILES: CC1=NN=C2C=C(N)C=CN21
Tpsa: 56.21
Logp: 0.61992
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 0
Purity:
97%
MDL No:
MFCD19707623
Storage:
4°C, protect from light
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₈N₄
Molecular Weight:
148.17
Synonyms:
3-Methyl[1,2,4]triazolo[4,3-a]pyridin-7-amine
SMILES:
CC1=NN=C2C=C(N)C=CN21
Tpsa:
56.21
Logp:
0.61992
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
0