CS-0536280
2-(1-(2-Fluorobenzyl)-1H-pyrazolo[3,4-b]pyridin-3-yl)-N5-methylpyrimidine-4,5,6-triamine
Manufacturer: ChemScene
CAS Number: 1702271-98-4
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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
C₁₈H₁₇FN₈
Molecular Weight
364.38
Synonyms
2-[1-(2-Fluorobenzyl)-1H-pyrazolo[3,4-b]pyridin-3-yl]-N5-methyl-4,5,6-pyrimidinetriamine
SMILES
FC=1C=CC=CC1CN2N=C(C=3N=C(N)C(NC)=C(N3)N)C=4C=CC=NC42
Tpsa
120.56
Logp
2.2818
H Acceptors
8
H Donors
3
Rotatable Bonds
4
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 1702271-98-4 | Riociguat Impurtiy 6 | A2B Chem | -- |
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: C₁₈H₁₇FN₈
Molecular Weight: 364.38
Synonyms: 2-[1-(2-Fluorobenzyl)-1H-pyrazolo[3,4-b]pyridin-3-yl]-N5-methyl-4,5,6-pyrimidinetriamine
SMILES: FC=1C=CC=CC1CN2N=C(C=3N=C(N)C(NC)=C(N3)N)C=4C=CC=NC42
Tpsa: 120.56
Logp: 2.2818
H Acceptors: 8
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:
C₁₈H₁₇FN₈
Molecular Weight:
364.38
Synonyms:
2-[1-(2-Fluorobenzyl)-1H-pyrazolo[3,4-b]pyridin-3-yl]-N5-methyl-4,5,6-pyrimidinetriamine
SMILES:
FC=1C=CC=CC1CN2N=C(C=3N=C(N)C(NC)=C(N3)N)C=4C=CC=NC42
Tpsa:
120.56
Logp:
2.2818
H Acceptors:
8
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: C₂₉H₃₆N₄O₄S
Molecular Weight: 536.69
Synonyms: None
SMILES: O=C1[C@@]2([C@@]([C@H]3C[C@@H]2CC3)(C(=O)N1C[C@H]4[C@H](COC(=O)N5CCN(CC5)C=6C=7C(SN6)=CC=CC7)CCCC4)[H])[H]
Tpsa: 83.05
Logp: 4.3924
H Acceptors: 7
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:
C₂₉H₃₆N₄O₄S
Molecular Weight:
536.69
Synonyms:
None
SMILES:
O=C1[C@@]2([C@@]([C@H]3C[C@@H]2CC3)(C(=O)N1C[C@H]4[C@H](COC(=O)N5CCN(CC5)C=6C=7C(SN6)=CC=CC7)CCCC4)[H])[H]
Tpsa:
83.05
Logp:
4.3924
H Acceptors:
7
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: C₁₄H₂₄Cl₂N₂
Molecular Weight: 291.26
Synonyms: Tofacitinib-3
SMILES: C[C@@H]1CCN(C[C@H]1NC)CC2=CC=CC=C2.Cl.Cl
Tpsa: 15.27
Logp: 2.96
H Acceptors: 2
H Donors: 1
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:
C₁₄H₂₄Cl₂N₂
Molecular Weight:
291.26
Synonyms:
Tofacitinib-3
SMILES:
C[C@@H]1CCN(C[C@H]1NC)CC2=CC=CC=C2.Cl.Cl
Tpsa:
15.27
Logp:
2.96
H Acceptors:
2
H Donors:
1
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: C₁₀H₁₀N₄O₃S₂
Molecular Weight: 298.34
Synonyms: N-(4-(2-amino-2-oxoethyl)thiazol-2-yl)-2-(2-aminothiazol-4-yl) acetamide
SMILES: O=C(O)CC=1N=C(SC1)NC(=O)CC=2N=C(SC2)N
Tpsa: 118.2
Logp: 0.9901
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:
C₁₀H₁₀N₄O₃S₂
Molecular Weight:
298.34
Synonyms:
N-(4-(2-amino-2-oxoethyl)thiazol-2-yl)-2-(2-aminothiazol-4-yl) acetamide
SMILES:
O=C(O)CC=1N=C(SC1)NC(=O)CC=2N=C(SC2)N
Tpsa:
118.2
Logp:
0.9901
H Acceptors:
7
H Donors:
3
Rotatable Bonds:
5