CS-0889392
(2S)-2-Amino-3-(5-oxo-3,5,6,7-tetrahydro-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propanoic acid hydrochloride
Manufacturer: ChemScene
CAS Number: 2892291-69-7
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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
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
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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: 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
Purity: 98%
MDL No: MFCD22689848
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₂BrN₃O
Molecular Weight: 282.14
Synonyms: None
SMILES: BrC1=CN=CC2=C1N(C3CCCCO3)N=C2
Tpsa: 39.94
Logp: 2.8929
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 1
Purity:
98%
MDL No:
MFCD22689848
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₂BrN₃O
Molecular Weight:
282.14
Synonyms:
None
SMILES:
BrC1=CN=CC2=C1N(C3CCCCO3)N=C2
Tpsa:
39.94
Logp:
2.8929
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
1
Purity: 97%
MDL No: MFCD26129734
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₁₂ClNO₄
Molecular Weight: 245.66
Synonyms: None
SMILES: O=C(OC)C1=C(Cl)N=CC=C1C(OC)OC
Tpsa: 57.65
Logp: 1.813
H Acceptors: 5
H Donors: 0
Rotatable Bonds: 4
Purity:
97%
MDL No:
MFCD26129734
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₁₂ClNO₄
Molecular Weight:
245.66
Synonyms:
None
SMILES:
O=C(OC)C1=C(Cl)N=CC=C1C(OC)OC
Tpsa:
57.65
Logp:
1.813
H Acceptors:
5
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: C₁₆H₂₀BNO₂
Molecular Weight: 269.15
Synonyms: None
SMILES: CC1(C)C(C)(C)OB(C2=CC=C3C=C(C)C=NC3=C2)O1
Tpsa: 31.35
Logp: 2.84242
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:
C₁₆H₂₀BNO₂
Molecular Weight:
269.15
Synonyms:
None
SMILES:
CC1(C)C(C)(C)OB(C2=CC=C3C=C(C)C=NC3=C2)O1
Tpsa:
31.35
Logp:
2.84242
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
1