CS-1090867
7-(Methylthio)-4-oxo-4,8-dihydro-[1,2,4]triazolo[5,1-c][1,2,4]triazine-3-carboxylic acid
Manufacturer: ChemScene
CAS Number: 372973-56-3
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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
C₆H₅N₅O₃S
Molecular Weight
227.20
Synonyms
None
SMILES
O=C(O)C1=NN=C2NC(=NN2C1=O)SC
Tpsa
113.24
Logp
-0.7673
H Acceptors
7
H Donors
2
Rotatable Bonds
2
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: C₆H₅N₅O₃S
Molecular Weight: 227.20
Synonyms: None
SMILES: O=C(O)C1=NN=C2NC(=NN2C1=O)SC
Tpsa: 113.24
Logp: -0.7673
H Acceptors: 7
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:
C₆H₅N₅O₃S
Molecular Weight:
227.20
Synonyms:
None
SMILES:
O=C(O)C1=NN=C2NC(=NN2C1=O)SC
Tpsa:
113.24
Logp:
-0.7673
H Acceptors:
7
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: C₁₁H₁₁Cl₂N₃
Molecular Weight: 256.13
Synonyms: None
SMILES: N#CC1=C(Cl)N=C(Cl)C2=C1CCN(C2)CC
Tpsa: 39.92
Logp: 2.63808
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:
C₁₁H₁₁Cl₂N₃
Molecular Weight:
256.13
Synonyms:
None
SMILES:
N#CC1=C(Cl)N=C(Cl)C2=C1CCN(C2)CC
Tpsa:
39.92
Logp:
2.63808
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: C₉H₅ClN₂O₂
Molecular Weight: 208.60
Synonyms: None
SMILES: O=CC=1N=C2C=CC=CN2C(=O)C1Cl
Tpsa: 51.44
Logp: 1.1604
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:
C₉H₅ClN₂O₂
Molecular Weight:
208.60
Synonyms:
None
SMILES:
O=CC=1N=C2C=CC=CN2C(=O)C1Cl
Tpsa:
51.44
Logp:
1.1604
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: C₁₀H₁₁N₃OS
Molecular Weight: 221.28
Synonyms: None
SMILES: O=C(N)C=1SC2=NC(=CC(N)=C2C1C)C
Tpsa: 82
Logp: 1.59424
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:
C₁₀H₁₁N₃OS
Molecular Weight:
221.28
Synonyms:
None
SMILES:
O=C(N)C=1SC2=NC(=CC(N)=C2C1C)C
Tpsa:
82
Logp:
1.59424
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
1