CS-1063846
5-(6-Bromo-4-oxo-4,7-dihydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl)pent-4-ynenitrile
Manufacturer: ChemScene
CAS Number: 2588326-99-0
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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
C₁₁H₇BrN₄O
Molecular Weight
291.10
Synonyms
None
SMILES
N#CCCC#CC1=C(Br)NC=2NC=NC(=O)C12
Tpsa
85.33
Logp
1.66898
H Acceptors
3
H Donors
2
Rotatable Bonds
1
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: C₁₁H₇BrN₄O
Molecular Weight: 291.10
Synonyms: None
SMILES: N#CCCC#CC1=C(Br)NC=2NC=NC(=O)C12
Tpsa: 85.33
Logp: 1.66898
H Acceptors: 3
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:
C₁₁H₇BrN₄O
Molecular Weight:
291.10
Synonyms:
None
SMILES:
N#CCCC#CC1=C(Br)NC=2NC=NC(=O)C12
Tpsa:
85.33
Logp:
1.66898
H Acceptors:
3
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: C₁₀H₆Cl₂N₂S
Molecular Weight: 257.14
Synonyms: None
SMILES: ClC1=NC=NC=2SC=C(C#CC(Cl)C)C12
Tpsa: 25.78
Logp: 3.3235
H Acceptors: 3
H Donors: 0
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:
C₁₀H₆Cl₂N₂S
Molecular Weight:
257.14
Synonyms:
None
SMILES:
ClC1=NC=NC=2SC=C(C#CC(Cl)C)C12
Tpsa:
25.78
Logp:
3.3235
H Acceptors:
3
H Donors:
0
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: C₇H₅BrN₂
Molecular Weight: 197.03
Synonyms: None
SMILES: BrC1=NC=C(C#CC)N=C1
Tpsa: 25.78
Logp: 1.6105
H Acceptors: 2
H Donors: 0
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:
C₇H₅BrN₂
Molecular Weight:
197.03
Synonyms:
None
SMILES:
BrC1=NC=C(C#CC)N=C1
Tpsa:
25.78
Logp:
1.6105
H Acceptors:
2
H Donors:
0
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: C₁₆H₁₆ClNO₂
Molecular Weight: 289.76
Synonyms: None
SMILES: O=C(OC(C)(C)C)N1C=CC=2C=C(C#CCCl)C=CC21
Tpsa: 31.23
Logp: 4.0148
H Acceptors: 3
H Donors: 0
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:
C₁₆H₁₆ClNO₂
Molecular Weight:
289.76
Synonyms:
None
SMILES:
O=C(OC(C)(C)C)N1C=CC=2C=C(C#CCCl)C=CC21
Tpsa:
31.23
Logp:
4.0148
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
0