AI12943
1203671-47-9 | 1-(Piperidin-1-yl)-2-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1h-pyrazol-1-yl)ethanone
Manufacturer: A2B Chem
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CatalogNumber
AI12943
ChemicalName
1-(Piperidin-1-yl)-2-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1h-pyrazol-1-yl)ethanone
CasNumber
1203671-47-9
MolecularFormula
C16H26BN3O3
MolecularWeight
319.2069
MdlNumber
MFCD17926461
Smiles
O=C(N1CCCCC1)Cn1ncc(c1)B1OC(C(O1)(C)C)(C)C
Complexity
436
Covalently-bondedUnitCount
1
HeavyAtomCount
23
HydrogenBondAcceptorCount
4
RotatableBondCount
3
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CatalogNumber: AI12943
ChemicalName: 1-(Piperidin-1-yl)-2-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1h-pyrazol-1-yl)ethanone
CasNumber: 1203671-47-9
MolecularFormula: C16H26BN3O3
MolecularWeight: 319.2069
MdlNumber: MFCD17926461
Smiles: O=C(N1CCCCC1)Cn1ncc(c1)B1OC(C(O1)(C)C)(C)C
Complexity: 436
Covalently-bondedUnitCount: 1
HeavyAtomCount: 23
HydrogenBondAcceptorCount: 4
RotatableBondCount: 3
CatalogNumber:
AI12943
ChemicalName:
1-(Piperidin-1-yl)-2-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1h-pyrazol-1-yl)ethanone
CasNumber:
1203671-47-9
MolecularFormula:
C16H26BN3O3
MolecularWeight:
319.2069
MdlNumber:
MFCD17926461
Smiles:
O=C(N1CCCCC1)Cn1ncc(c1)B1OC(C(O1)(C)C)(C)C
Complexity:
436
Covalently-bondedUnitCount:
1
HeavyAtomCount:
23
HydrogenBondAcceptorCount:
4
RotatableBondCount:
3
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Smiles: O=C(N1CC(C1)c1ccc(cc1)Br)OC(C)(C)C
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O=C(N1CC(C1)c1ccc(cc1)Br)OC(C)(C)C
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Smiles: Fc1ccc(cc1)C1CNC1.Cl
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Fc1ccc(cc1)C1CNC1.Cl
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Smiles: Brc1cccc(c1)C1CNC1
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Smiles:
Brc1cccc(c1)C1CNC1
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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