CS-0592145
2-((4-Methyl-4H-1,2,4-triazol-3-yl)thio)-1-(1H-pyrrol-2-yl)ethan-1-one
Manufacturer: ChemScene
CAS Number: 1154638-62-6
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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
C₉H₁₀N₄OS
Molecular Weight
222.27
Synonyms
None
SMILES
CN1C=NN=C1SCC(=O)C2=CC=CN2
Tpsa
63.57
Logp
1.1182
H Acceptors
5
H Donors
1
Rotatable Bonds
4
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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
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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: C₉H₁₀N₄OS
Molecular Weight: 222.27
Synonyms: None
SMILES: CN1C=NN=C1SCC(=O)C2=CC=CN2
Tpsa: 63.57
Logp: 1.1182
H Acceptors: 5
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:
C₉H₁₀N₄OS
Molecular Weight:
222.27
Synonyms:
None
SMILES:
CN1C=NN=C1SCC(=O)C2=CC=CN2
Tpsa:
63.57
Logp:
1.1182
H Acceptors:
5
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: C₈H₇ClN₂O₂S
Molecular Weight: 230.67
Synonyms: None
SMILES: CN1C2=CC=CC=C2S(=O)(=O)N=C1Cl
Tpsa: 49.74
Logp: 1.4199
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₇ClN₂O₂S
Molecular Weight:
230.67
Synonyms:
None
SMILES:
CN1C2=CC=CC=C2S(=O)(=O)N=C1Cl
Tpsa:
49.74
Logp:
1.4199
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₉N₃
Molecular Weight: 169.27
Synonyms: None
SMILES: C1CC2CN(CCN2C1)CCN
Tpsa: 32.5
Logp: -0.2749
H Acceptors: 3
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:
C₉H₁₉N₃
Molecular Weight:
169.27
Synonyms:
None
SMILES:
C1CC2CN(CCN2C1)CCN
Tpsa:
32.5
Logp:
-0.2749
H Acceptors:
3
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: C₁₃H₈N₂O₂S
Molecular Weight: 256.28
Synonyms: None
SMILES: C1=CC=C2C(=C1)C(=C(C2=O)/C=N/C3=NC=CS3)O
Tpsa: 62.55
Logp: 3.011
H Acceptors: 5
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:
C₁₃H₈N₂O₂S
Molecular Weight:
256.28
Synonyms:
None
SMILES:
C1=CC=C2C(=C1)C(=C(C2=O)/C=N/C3=NC=CS3)O
Tpsa:
62.55
Logp:
3.011
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
2