AI62842
940285-00-7 | 2-(4-Ethyl-piperazin-1-yl)pyridine-5-boronic acid pinacol ester
Manufacturer: A2B Chem
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CatalogNumber
AI62842
ChemicalName
2-(4-Ethyl-piperazin-1-yl)pyridine-5-boronic acid pinacol ester
CasNumber
940285-00-7
MolecularFormula
C17H28BN3O2
MolecularWeight
317.2341
MdlNumber
MFCD11975412
Smiles
CCN1CCN(CC1)c1ccc(cn1)B1OC(C(O1)(C)C)(C)C
Complexity
395
Covalently-bondedUnitCount
1
HeavyAtomCount
23
HydrogenBondAcceptorCount
5
RotatableBondCount
3
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CatalogNumber: AI62842
ChemicalName: 2-(4-Ethyl-piperazin-1-yl)pyridine-5-boronic acid pinacol ester
CasNumber: 940285-00-7
MolecularFormula: C17H28BN3O2
MolecularWeight: 317.2341
MdlNumber: MFCD11975412
Smiles: CCN1CCN(CC1)c1ccc(cn1)B1OC(C(O1)(C)C)(C)C
Complexity: 395
Covalently-bondedUnitCount: 1
HeavyAtomCount: 23
HydrogenBondAcceptorCount: 5
RotatableBondCount: 3
CatalogNumber:
AI62842
ChemicalName:
2-(4-Ethyl-piperazin-1-yl)pyridine-5-boronic acid pinacol ester
CasNumber:
940285-00-7
MolecularFormula:
C17H28BN3O2
MolecularWeight:
317.2341
MdlNumber:
MFCD11975412
Smiles:
CCN1CCN(CC1)c1ccc(cn1)B1OC(C(O1)(C)C)(C)C
Complexity:
395
Covalently-bondedUnitCount:
1
HeavyAtomCount:
23
HydrogenBondAcceptorCount:
5
RotatableBondCount:
3
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Smiles: O=C(c1ccc(cn1)B1OC(C(O1)(C)C)(C)C)N1CCCC1
Complexity: __
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RotatableBondCount: __
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Smiles:
O=C(c1ccc(cn1)B1OC(C(O1)(C)C)(C)C)N1CCCC1
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Smiles: Clc1ccc(cc1n1cccc1)[N+](=O)[O-]
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Smiles:
Clc1ccc(cc1n1cccc1)[N+](=O)[O-]
Complexity:
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HydrogenBondAcceptorCount:
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Smiles: Clc1cccc(c1)C(=O)NC1CC1
Complexity: 203
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
Clc1cccc(c1)C(=O)NC1CC1
Complexity:
203
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__