CS-0531466
(5-Bromo-1H-pyrrolo[2,3-b]pyridin-3-yl)(phenyl)methanone
Manufacturer: ChemScene
CAS Number: 858117-40-5
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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
C₁₄H₉BrN₂O
Molecular Weight
301.14
Synonyms
(5-bromo-1H-pyrrolo[2,3-b]pyridine-3-yl)-phenyl-methanone
SMILES
O=C(C1=CNC2=NC=C(Br)C=C21)C3=CC=CC=C3
Tpsa
45.75
Logp
3.5564
H Acceptors
2
H Donors
1
Rotatable Bonds
2
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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: C₁₄H₉BrN₂O
Molecular Weight: 301.14
Synonyms: (5-bromo-1H-pyrrolo[2,3-b]pyridine-3-yl)-phenyl-methanone
SMILES: O=C(C1=CNC2=NC=C(Br)C=C21)C3=CC=CC=C3
Tpsa: 45.75
Logp: 3.5564
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:
C₁₄H₉BrN₂O
Molecular Weight:
301.14
Synonyms:
(5-bromo-1H-pyrrolo[2,3-b]pyridine-3-yl)-phenyl-methanone
SMILES:
O=C(C1=CNC2=NC=C(Br)C=C21)C3=CC=CC=C3
Tpsa:
45.75
Logp:
3.5564
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: C₈H₁₀BNO₅
Molecular Weight: 210.98
Synonyms: Acetic acid, [(5-borono-2-pyridinyl)oxy]-, 1-methyl ester (9CI)
SMILES: O=C(OC)COC1=NC=C(B(O)O)C=C1
Tpsa: 88.88
Logp: -1.6868
H Acceptors: 6
H Donors: 2
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:
C₈H₁₀BNO₅
Molecular Weight:
210.98
Synonyms:
Acetic acid, [(5-borono-2-pyridinyl)oxy]-, 1-methyl ester (9CI)
SMILES:
O=C(OC)COC1=NC=C(B(O)O)C=C1
Tpsa:
88.88
Logp:
-1.6868
H Acceptors:
6
H Donors:
2
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: C₁₀H₇BrClNO
Molecular Weight: 272.53
Synonyms: None
SMILES: COC1=C(Br)C=C2N=CC=C(Cl)C2=C1
Tpsa: 22.12
Logp: 3.6593
H Acceptors: 2
H Donors: 0
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:
C₁₀H₇BrClNO
Molecular Weight:
272.53
Synonyms:
None
SMILES:
COC1=C(Br)C=C2N=CC=C(Cl)C2=C1
Tpsa:
22.12
Logp:
3.6593
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
1
Purity: 98%
MDL No: None
Storage: 4°C, stored under nitrogen
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₆H₁₂N₂O₃
Molecular Weight: 280.28
Synonyms: N-Formyl Oxcarbazepine
SMILES: O=CNC(N1C2=C(C(CC3=C1C=CC=C3)=O)C=CC=C2)=O
Tpsa: 66.48
Logp: 2.4295
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
4°C, stored under nitrogen
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₁₂N₂O₃
Molecular Weight:
280.28
Synonyms:
N-Formyl Oxcarbazepine
SMILES:
O=CNC(N1C2=C(C(CC3=C1C=CC=C3)=O)C=CC=C2)=O
Tpsa:
66.48
Logp:
2.4295
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
1