CS-1003560
Adenosine, 2-[4-[(ethylamino)carbonyl]-1H-pyrazol-1-yl]-
Manufacturer: ChemScene
CAS Number: 313348-33-3
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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
C₁₆H₂₀N₈O₅
Molecular Weight
404.38
Synonyms
None
SMILES
O[C@H]1[C@H](N2C=3C(N=C2)=C(N)N=C(N3)N4C=C(C(NCC)=O)C=N4)O[C@H](CO)[C@H]1O
Tpsa
186.46
Logp
-2.0446
H Acceptors
12
H Donors
5
Rotatable Bonds
5
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SAFETY INFORMATION
ghsPictogramUrl
https://dev-s3.chemscene.com/web-image/physicalization/irritant.svg
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: C₁₆H₂₀N₈O₅
Molecular Weight: 404.38
Synonyms: None
SMILES: O[C@H]1[C@H](N2C=3C(N=C2)=C(N)N=C(N3)N4C=C(C(NCC)=O)C=N4)O[C@H](CO)[C@H]1O
Tpsa: 186.46
Logp: -2.0446
H Acceptors: 12
H Donors: 5
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₂₀N₈O₅
Molecular Weight:
404.38
Synonyms:
None
SMILES:
O[C@H]1[C@H](N2C=3C(N=C2)=C(N)N=C(N3)N4C=C(C(NCC)=O)C=N4)O[C@H](CO)[C@H]1O
Tpsa:
186.46
Logp:
-2.0446
H Acceptors:
12
H Donors:
5
Rotatable Bonds:
5
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₃H₂₆FN₃O
Molecular Weight: 379.47
Synonyms: None
SMILES: C(CCC(=O)C1=CC=C(F)C=C1)N2C[C@]3(C=4C=5N([C@]3(CC2)[H])CCNC5C=CC4)[H]
Tpsa: 35.58
Logp: 3.8922
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₃H₂₆FN₃O
Molecular Weight:
379.47
Synonyms:
None
SMILES:
C(CCC(=O)C1=CC=C(F)C=C1)N2C[C@]3(C=4C=5N([C@]3(CC2)[H])CCNC5C=CC4)[H]
Tpsa:
35.58
Logp:
3.8922
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
5
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₄H₂₈FN₃O
Molecular Weight: 393.50
Synonyms: None
SMILES: CN1C2=C3C([C@@]4([C@](N3CC1)(CCN(CCCC(=O)C5=CC=C(F)C=C5)C4)[H])[H])=CC=C2
Tpsa: 26.79
Logp: 3.9165
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₄H₂₈FN₃O
Molecular Weight:
393.50
Synonyms:
None
SMILES:
CN1C2=C3C([C@@]4([C@](N3CC1)(CCN(CCCC(=O)C5=CC=C(F)C=C5)C4)[H])[H])=CC=C2
Tpsa:
26.79
Logp:
3.9165
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
5
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₆H₁₇N₃O₃
Molecular Weight: 299.32
Synonyms: None
SMILES: O=C(OCC)N1CC=2C=3C=CC=C4NC(=O)CN(C43)C2CC1
Tpsa: 63.57
Logp: 2.108
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 1
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₁₇N₃O₃
Molecular Weight:
299.32
Synonyms:
None
SMILES:
O=C(OCC)N1CC=2C=3C=CC=C4NC(=O)CN(C43)C2CC1
Tpsa:
63.57
Logp:
2.108
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
1