CS-1079628
(S)-3-Bromo-5-(tert-butoxycarbonyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-6-carboxylic acid
Manufacturer: ChemScene
CAS Number: 2920219-65-2
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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
C₁₂H₁₆BrN₃O₄
Molecular Weight
346.18
Synonyms
None
SMILES
C(OC(C)(C)C)(=O)N1[C@H](C(O)=O)CN2C(C1)=C(Br)C=N2
Tpsa
84.66
Logp
1.8495
H Acceptors
5
H Donors
1
Rotatable Bonds
1
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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: C₁₂H₁₆BrN₃O₄
Molecular Weight: 346.18
Synonyms: None
SMILES: C(OC(C)(C)C)(=O)N1[C@H](C(O)=O)CN2C(C1)=C(Br)C=N2
Tpsa: 84.66
Logp: 1.8495
H Acceptors: 5
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:
C₁₂H₁₆BrN₃O₄
Molecular Weight:
346.18
Synonyms:
None
SMILES:
C(OC(C)(C)C)(=O)N1[C@H](C(O)=O)CN2C(C1)=C(Br)C=N2
Tpsa:
84.66
Logp:
1.8495
H Acceptors:
5
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: C₁₉H₂₁NO₂
Molecular Weight: 295.38
Synonyms: None
SMILES: C(N1[C@@H](C)[C@H](C(OC)=O)C1)(C2=CC=CC=C2)C3=CC=CC=C3
Tpsa: 29.54
Logp: 3.2693
H Acceptors: 3
H Donors: 0
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:
C₁₉H₂₁NO₂
Molecular Weight:
295.38
Synonyms:
None
SMILES:
C(N1[C@@H](C)[C@H](C(OC)=O)C1)(C2=CC=CC=C2)C3=CC=CC=C3
Tpsa:
29.54
Logp:
3.2693
H Acceptors:
3
H Donors:
0
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: C₁₂H₂₂N₂O₄
Molecular Weight: 258.31
Synonyms: None
SMILES: C(O)(=O)[C@@]1(N)[C@@H](CC)CN(C(OC(C)(C)C)=O)C1
Tpsa: 92.86
Logp: 1.0454
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:
C₁₂H₂₂N₂O₄
Molecular Weight:
258.31
Synonyms:
None
SMILES:
C(O)(=O)[C@@]1(N)[C@@H](CC)CN(C(OC(C)(C)C)=O)C1
Tpsa:
92.86
Logp:
1.0454
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: C₁₁H₂₀FNO₅S
Molecular Weight: 297.34
Synonyms: None
SMILES: O(S(CC)(=O)=O)[C@H]1CN(C(OC(C)(C)C)=O)C[C@@H]1F
Tpsa: 72.91
Logp: 1.3101
H Acceptors: 5
H Donors: 0
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₂₀FNO₅S
Molecular Weight:
297.34
Synonyms:
None
SMILES:
O(S(CC)(=O)=O)[C@H]1CN(C(OC(C)(C)C)=O)C[C@@H]1F
Tpsa:
72.91
Logp:
1.3101
H Acceptors:
5
H Donors:
0
Rotatable Bonds:
3