CS-1000051
N-[3-[4-Amino-7-(2-deoxy-3-O-2-propen-1-yl-β-D-erythro-pentofuranosyl)-7H-pyrrolo[2,3-d]pyrimidin-5-yl]-2-propyn-1-yl]-2,2,2-trifluoroacetamide
Manufacturer: ChemScene
CAS Number: 666848-37-9
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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
C₁₉H₂₀F₃N₅O₄
Molecular Weight
439.39
Synonyms
None
SMILES
C(#CCNC(C(F)(F)F)=O)C1=CN(C=2C1=C(N)N=CN2)[C@H]3C[C@H](OCC=C)[C@@H](CO)O3
Tpsa
124.52
Logp
0.8945
H Acceptors
8
H Donors
3
Rotatable Bonds
6
Related Products
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: C₁₉H₂₀F₃N₅O₄
Molecular Weight: 439.39
Synonyms: None
SMILES: C(#CCNC(C(F)(F)F)=O)C1=CN(C=2C1=C(N)N=CN2)[C@H]3C[C@H](OCC=C)[C@@H](CO)O3
Tpsa: 124.52
Logp: 0.8945
H Acceptors: 8
H Donors: 3
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₉H₂₀F₃N₅O₄
Molecular Weight:
439.39
Synonyms:
None
SMILES:
C(#CCNC(C(F)(F)F)=O)C1=CN(C=2C1=C(N)N=CN2)[C@H]3C[C@H](OCC=C)[C@@H](CO)O3
Tpsa:
124.52
Logp:
0.8945
H Acceptors:
8
H Donors:
3
Rotatable Bonds:
6
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₇H₃₁IN₄O₃Si
Molecular Weight: 614.55
Synonyms: None
SMILES: [Si](OC[C@H]1O[C@H](C[C@@H]1O)N2C=3C(C(I)=C2)=C(N)N=CN3)(C(C)(C)C)(C4=CC=CC=C4)C5=CC=CC=C5
Tpsa: 95.42
Logp: 3.8431
H Acceptors: 7
H Donors: 2
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₇H₃₁IN₄O₃Si
Molecular Weight:
614.55
Synonyms:
None
SMILES:
[Si](OC[C@H]1O[C@H](C[C@@H]1O)N2C=3C(C(I)=C2)=C(N)N=CN3)(C(C)(C)C)(C4=CC=CC=C4)C5=CC=CC=C5
Tpsa:
95.42
Logp:
3.8431
H Acceptors:
7
H Donors:
2
Rotatable Bonds:
6
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₁₇IN₄O₄
Molecular Weight: 432.21
Synonyms: None
SMILES: IC=1C2=C(N(C1)[C@H]3C[C@H](OCC=C)[C@@H](CO)O3)NC(N)=NC2=O
Tpsa: 115.39
Logp: 0.7624
H Acceptors: 7
H Donors: 3
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:
C₁₄H₁₇IN₄O₄
Molecular Weight:
432.21
Synonyms:
None
SMILES:
IC=1C2=C(N(C1)[C@H]3C[C@H](OCC=C)[C@@H](CO)O3)NC(N)=NC2=O
Tpsa:
115.39
Logp:
0.7624
H Acceptors:
7
H Donors:
3
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: C₁₇H₂₇IN₄O₄Si
Molecular Weight: 506.41
Synonyms: None
SMILES: IC1=CN(C2=C1C(=O)N=C(N)N2)[C@@H]3O[C@H](CO[Si](C(C)(C)C)(C)C)[C@@H](O)C3
Tpsa: 115.39
Logp: 2.5816
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:
C₁₇H₂₇IN₄O₄Si
Molecular Weight:
506.41
Synonyms:
None
SMILES:
IC1=CN(C2=C1C(=O)N=C(N)N2)[C@@H]3O[C@H](CO[Si](C(C)(C)C)(C)C)[C@@H](O)C3
Tpsa:
115.39
Logp:
2.5816
H Acceptors:
7
H Donors:
3
Rotatable Bonds:
4