CS-1082949
2-(Methylthio)-7-oxo-3,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylic acid
Manufacturer: ChemScene
CAS Number: 296896-23-6
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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
C₇H₆N₄O₃S
Molecular Weight
226.21
Synonyms
None
SMILES
O=C(O)C1=CN=C2NC(=NN2C1=O)SC
Tpsa
100.35
Logp
-0.1623
H Acceptors
6
H Donors
2
Rotatable Bonds
2
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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: C₇H₆N₄O₃S
Molecular Weight: 226.21
Synonyms: None
SMILES: O=C(O)C1=CN=C2NC(=NN2C1=O)SC
Tpsa: 100.35
Logp: -0.1623
H Acceptors: 6
H Donors: 2
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:
C₇H₆N₄O₃S
Molecular Weight:
226.21
Synonyms:
None
SMILES:
O=C(O)C1=CN=C2NC(=NN2C1=O)SC
Tpsa:
100.35
Logp:
-0.1623
H Acceptors:
6
H Donors:
2
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: C₉H₄ClN₃O
Molecular Weight: 205.60
Synonyms: None
SMILES: N#CC1=NC=2C(Cl)=CNC2C(C=O)=C1
Tpsa: 69.54
Logp: 1.90048
H Acceptors: 3
H Donors: 1
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:
C₉H₄ClN₃O
Molecular Weight:
205.60
Synonyms:
None
SMILES:
N#CC1=NC=2C(Cl)=CNC2C(C=O)=C1
Tpsa:
69.54
Logp:
1.90048
H Acceptors:
3
H Donors:
1
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: C₁₀H₇N₃O
Molecular Weight: 185.18
Synonyms: None
SMILES: N#CC1=NC=2C=CN(C2C(C=O)=C1)C
Tpsa: 58.68
Logp: 1.25748
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:
C₁₀H₇N₃O
Molecular Weight:
185.18
Synonyms:
None
SMILES:
N#CC1=NC=2C=CN(C2C(C=O)=C1)C
Tpsa:
58.68
Logp:
1.25748
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: C₁₁H₉N₃
Molecular Weight: 183.21
Synonyms: None
SMILES: N#CC1=NC=2C=CN(C2C(C=C)=C1)C
Tpsa: 41.61
Logp: 2.08798
H Acceptors: 3
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:
C₁₁H₉N₃
Molecular Weight:
183.21
Synonyms:
None
SMILES:
N#CC1=NC=2C=CN(C2C(C=C)=C1)C
Tpsa:
41.61
Logp:
2.08798
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
1