CS-0716525
4-Chloro-5-nitro-2-(propylthio)pyrimidine Ticagrelor Impurity
Manufacturer: ChemScene
CAS Number: 2518331-26-3
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Purity
98%
MDL No
None
Storage
-20°C, sealed storage, away from moisture
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₇H₈ClN₃O₂S
Molecular Weight
233.68
Synonyms
None
SMILES
O=[N+]([O-])C1=CN=C(SCCC)N=C1Cl
Tpsa
68.92
Logp
2.5403
H Acceptors
5
H Donors
0
Rotatable Bonds
4
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 2518331-26-3 | 4-Chloro-5-nitro-2-(propylthio)pyrimidine | A2B Chem | -- |
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SAFETY INFORMATION
ghsPictogramUrl
https://dev-s3.chemscene.com/web-image/physicalization/corrosive.svg
Pictograms
Signal Word
Danger
UN Number
3077
Class
9
Packing Group
Ⅲ
Hazard Statements
Precautionary Statements
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Purity: 98%
MDL No: None
Storage: -20°C, sealed storage, away from moisture
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₈ClN₃O₂S
Molecular Weight: 233.68
Synonyms: None
SMILES: O=[N+]([O-])C1=CN=C(SCCC)N=C1Cl
Tpsa: 68.92
Logp: 2.5403
H Acceptors: 5
H Donors: 0
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
-20°C, sealed storage, away from moisture
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₈ClN₃O₂S
Molecular Weight:
233.68
Synonyms:
None
SMILES:
O=[N+]([O-])C1=CN=C(SCCC)N=C1Cl
Tpsa:
68.92
Logp:
2.5403
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: C₈H₁₆F₂N₂
Molecular Weight: 178.22
Synonyms: None
SMILES: CC(F)(F)CN1CCNCCC1
Tpsa: 15.27
Logp: 0.9369
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₁₆F₂N₂
Molecular Weight:
178.22
Synonyms:
None
SMILES:
CC(F)(F)CN1CCNCCC1
Tpsa:
15.27
Logp:
0.9369
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
2
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₈H₂₈N₂O₄
Molecular Weight: 336.43
Synonyms: None
SMILES: O=C(OCC1=CC=CC=C1)NC(C(NC(C)COC)=O)C(C)CC
Tpsa: 76.66
Logp: 2.4786
H Acceptors: 4
H Donors: 2
Rotatable Bonds: 9
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₈H₂₈N₂O₄
Molecular Weight:
336.43
Synonyms:
None
SMILES:
O=C(OCC1=CC=CC=C1)NC(C(NC(C)COC)=O)C(C)CC
Tpsa:
76.66
Logp:
2.4786
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
9
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀₀H₁₆₅N₂₅O₂₈S₂
Molecular Weight: 2229.66
Synonyms: None
SMILES: O=C(N[C@@H](CO)C(N[C@@H](CCSC)C(N[C@@H](CCCCN)C(N[C@@H](CCC(O)=O)C(N[C@@H]([C@H](O)C)C(N[C@@H]([C@H](O)C)C(N[C@@H](CCSC)C(N[C@@H](CCCCN)C(N[C@@H]([C@@H](C)CC)C(N[C@@H]([C@@H](C)CC)C(N1[C@@H](CCC1)C(N[C@@H](CC2=CC=CC=C2)C(N[C@@H](CC(N)=O)C(N[C@@H](CCCNC(N)=N)C(N[C@@H](CC(C)C)C(N[C@@H](CO)C(N[C@@H]([C@@H](C)CC)C(NCC(O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)[C@H](CC3=CC=C(C=C3)O)N
Tpsa: 873.81
Logp: -6.84843
H Acceptors: 32
H Donors: 31
Rotatable Bonds: 75
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀₀H₁₆₅N₂₅O₂₈S₂
Molecular Weight:
2229.66
Synonyms:
None
SMILES:
O=C(N[C@@H](CO)C(N[C@@H](CCSC)C(N[C@@H](CCCCN)C(N[C@@H](CCC(O)=O)C(N[C@@H]([C@H](O)C)C(N[C@@H]([C@H](O)C)C(N[C@@H](CCSC)C(N[C@@H](CCCCN)C(N[C@@H]([C@@H](C)CC)C(N[C@@H]([C@@H](C)CC)C(N1[C@@H](CCC1)C(N[C@@H](CC2=CC=CC=C2)C(N[C@@H](CC(N)=O)C(N[C@@H](CCCNC(N)=N)C(N[C@@H](CC(C)C)C(N[C@@H](CO)C(N[C@@H]([C@@H](C)CC)C(NCC(O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)[C@H](CC3=CC=C(C=C3)O)N
Tpsa:
873.81
Logp:
-6.84843
H Acceptors:
32
H Donors:
31
Rotatable Bonds:
75