CS-0889389
(2S)-2-((tert-Butoxycarbonyl)amino)-3-(5-oxo-1,5,6,7-tetrahydro-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propanoic acid
Manufacturer: ChemScene
CAS Number: 2892291-70-0
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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
C₁₃H₁₉N₅O₅
Molecular Weight
325.32
Synonyms
None
SMILES
O=C(O)[C@@H](NC(OC(C)(C)C)=O)CC1C(N=C2N(NC=N2)C1)=O
Tpsa
132.69
Logp
-0.2847
H Acceptors
7
H Donors
3
Rotatable Bonds
4
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: C₁₃H₁₉N₅O₅
Molecular Weight: 325.32
Synonyms: None
SMILES: O=C(O)[C@@H](NC(OC(C)(C)C)=O)CC1C(N=C2N(NC=N2)C1)=O
Tpsa: 132.69
Logp: -0.2847
H Acceptors: 7
H Donors: 3
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:
C₁₃H₁₉N₅O₅
Molecular Weight:
325.32
Synonyms:
None
SMILES:
O=C(O)[C@@H](NC(OC(C)(C)C)=O)CC1C(N=C2N(NC=N2)C1)=O
Tpsa:
132.69
Logp:
-0.2847
H Acceptors:
7
H Donors:
3
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: C₁₄H₂₂N₂O₅
Molecular Weight: 298.33
Synonyms: None
SMILES: O=C(O)[C@@H](NC(OC(C)(C)C)=O)C[C@H](C1)C(NC21CC2)=O
Tpsa: 104.73
Logp: 1.0231
H Acceptors: 4
H Donors: 3
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:
C₁₄H₂₂N₂O₅
Molecular Weight:
298.33
Synonyms:
None
SMILES:
O=C(O)[C@@H](NC(OC(C)(C)C)=O)C[C@H](C1)C(NC21CC2)=O
Tpsa:
104.73
Logp:
1.0231
H Acceptors:
4
H Donors:
3
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: C₁₂H₂₀ClNO₂
Molecular Weight: 245.75
Synonyms: None
SMILES: O=C([C@H]1NC[C@]2([H])C3CCC(CC3)[C@]12[H])OC.Cl
Tpsa: 38.33
Logp: 1.6054
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:
C₁₂H₂₀ClNO₂
Molecular Weight:
245.75
Synonyms:
None
SMILES:
O=C([C@H]1NC[C@]2([H])C3CCC(CC3)[C@]12[H])OC.Cl
Tpsa:
38.33
Logp:
1.6054
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: C₈H₁₂ClN₅O₃
Molecular Weight: 261.67
Synonyms: None
SMILES: O=C(O)[C@@H](N)CC1C(N=C2N(N=CN2)C1)=O.Cl
Tpsa: 120.38
Logp: -1.4289
H Acceptors: 6
H Donors: 3
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:
C₈H₁₂ClN₅O₃
Molecular Weight:
261.67
Synonyms:
None
SMILES:
O=C(O)[C@@H](N)CC1C(N=C2N(N=CN2)C1)=O.Cl
Tpsa:
120.38
Logp:
-1.4289
H Acceptors:
6
H Donors:
3
Rotatable Bonds:
3