CS-1063064
5-((1-Chloroisoquinolin-5-yl)ethynyl)pyrimidine-2,4(1H,3H)-dione
Manufacturer: ChemScene
CAS Number: 2570664-25-2
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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
C₁₅H₈ClN₃O₂
Molecular Weight
297.70
Synonyms
None
SMILES
O=C1NC=C(C#CC2=CC=CC=3C(Cl)=NC=CC23)C(=O)N1
Tpsa
78.61
Logp
1.6646
H Acceptors
3
H Donors
2
Rotatable Bonds
0
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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: C₁₅H₈ClN₃O₂
Molecular Weight: 297.70
Synonyms: None
SMILES: O=C1NC=C(C#CC2=CC=CC=3C(Cl)=NC=CC23)C(=O)N1
Tpsa: 78.61
Logp: 1.6646
H Acceptors: 3
H Donors: 2
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₅H₈ClN₃O₂
Molecular Weight:
297.70
Synonyms:
None
SMILES:
O=C1NC=C(C#CC2=CC=CC=3C(Cl)=NC=CC23)C(=O)N1
Tpsa:
78.61
Logp:
1.6646
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₂BrN₃O
Molecular Weight: 294.15
Synonyms: None
SMILES: C(#C[C@H](CC)C)C=1C2=C(NC1Br)NC=NC2=O
Tpsa: 61.54
Logp: 2.4113
H Acceptors: 2
H Donors: 2
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:
C₁₂H₁₂BrN₃O
Molecular Weight:
294.15
Synonyms:
None
SMILES:
C(#C[C@H](CC)C)C=1C2=C(NC1Br)NC=NC2=O
Tpsa:
61.54
Logp:
2.4113
H Acceptors:
2
H Donors:
2
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: C₉H₆BrN₃O₂
Molecular Weight: 268.07
Synonyms: None
SMILES: O=C1N=CNC=2NC(C#CCO)=C(Br)C12
Tpsa: 81.77
Logp: 0.3575
H Acceptors: 3
H Donors: 3
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₆BrN₃O₂
Molecular Weight:
268.07
Synonyms:
None
SMILES:
O=C1N=CNC=2NC(C#CCO)=C(Br)C12
Tpsa:
81.77
Logp:
0.3575
H Acceptors:
3
H Donors:
3
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₆ClN₃O
Molecular Weight: 207.62
Synonyms: None
SMILES: ClC1=NC=NC=2C(C#CCO)=CNC12
Tpsa: 61.8
Logp: 0.9551
H Acceptors: 3
H Donors: 2
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₆ClN₃O
Molecular Weight:
207.62
Synonyms:
None
SMILES:
ClC1=NC=NC=2C(C#CCO)=CNC12
Tpsa:
61.8
Logp:
0.9551
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
0