CS-0905941
1-tert-Butyl 3-methyl 7-oxo-6,7-dihydro-1H-pyrazolo[4,3-d]pyrimidine-1,3-dicarboxylate
Manufacturer: ChemScene
CAS Number: 2839502-25-7
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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
C₁₂H₁₄N₄O₅
Molecular Weight
294.26
Synonyms
None
SMILES
O=C(N1N=C(C(OC)=O)C(N=CN2)=C1C2=O)OC(C)(C)C
Tpsa
116.17
Logp
0.6894
H Acceptors
8
H Donors
1
Rotatable Bonds
1
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: C₁₂H₁₄N₄O₅
Molecular Weight: 294.26
Synonyms: None
SMILES: O=C(N1N=C(C(OC)=O)C(N=CN2)=C1C2=O)OC(C)(C)C
Tpsa: 116.17
Logp: 0.6894
H Acceptors: 8
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:
C₁₂H₁₄N₄O₅
Molecular Weight:
294.26
Synonyms:
None
SMILES:
O=C(N1N=C(C(OC)=O)C(N=CN2)=C1C2=O)OC(C)(C)C
Tpsa:
116.17
Logp:
0.6894
H Acceptors:
8
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: C₅H₁₀ClNO₄S
Molecular Weight: 215.66
Synonyms: None
SMILES: O=C(O)CC(C1)(N)CS1(=O)=O.Cl
Tpsa: 97.46
Logp: -0.9912
H Acceptors: 4
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:
C₅H₁₀ClNO₄S
Molecular Weight:
215.66
Synonyms:
None
SMILES:
O=C(O)CC(C1)(N)CS1(=O)=O.Cl
Tpsa:
97.46
Logp:
-0.9912
H Acceptors:
4
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: C₄H₇F₂NO₂S
Molecular Weight: 171.17
Synonyms: None
SMILES: NC(C1)(C(F)F)CS1(=O)=O
Tpsa: 60.16
Logp: -0.6226
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:
C₄H₇F₂NO₂S
Molecular Weight:
171.17
Synonyms:
None
SMILES:
NC(C1)(C(F)F)CS1(=O)=O
Tpsa:
60.16
Logp:
-0.6226
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: C₈H₆ClN₃OS
Molecular Weight: 227.67
Synonyms: None
SMILES: CC(NC1=CSC2=C(Cl)N=CN=C21)=O
Tpsa: 54.88
Logp: 2.3031
H Acceptors: 4
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:
C₈H₆ClN₃OS
Molecular Weight:
227.67
Synonyms:
None
SMILES:
CC(NC1=CSC2=C(Cl)N=CN=C21)=O
Tpsa:
54.88
Logp:
2.3031
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
1