AA32399
1190875-39-8 | 1-(1-BOC-Piperidino)pyrazole-4-boronic acid
Manufacturer: A2B Chem
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CatalogNumber
AA32399
ChemicalName
1-(1-BOC-Piperidino)pyrazole-4-boronic acid
CasNumber
1190875-39-8
MolecularFormula
C13H22BN3O4
MolecularWeight
295.1425
MdlNumber
MFCD12913942
Smiles
OB(c1cnn(c1)C1CCN(CC1)C(=O)OC(C)(C)C)O
Complexity
367
Covalently-bondedUnitCount
1
HeavyAtomCount
21
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
2
RotatableBondCount
4
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CatalogNumber: AA32399
ChemicalName: 1-(1-BOC-Piperidino)pyrazole-4-boronic acid
CasNumber: 1190875-39-8
MolecularFormula: C13H22BN3O4
MolecularWeight: 295.1425
MdlNumber: MFCD12913942
Smiles: OB(c1cnn(c1)C1CCN(CC1)C(=O)OC(C)(C)C)O
Complexity: 367
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 4
CatalogNumber:
AA32399
ChemicalName:
1-(1-BOC-Piperidino)pyrazole-4-boronic acid
CasNumber:
1190875-39-8
MolecularFormula:
C13H22BN3O4
MolecularWeight:
295.1425
MdlNumber:
MFCD12913942
Smiles:
OB(c1cnn(c1)C1CCN(CC1)C(=O)OC(C)(C)C)O
Complexity:
367
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
4
CatalogNumber: __
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Smiles: Clc1ccc(cc1)Nc1nccc2c1ccc(c2Nc1ncccc1c1ncnc2c1nc[nH]2)C.Cl.Cl
Complexity: __
Covalently-bondedUnitCount: __
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Smiles:
Clc1ccc(cc1)Nc1nccc2c1ccc(c2Nc1ncccc1c1ncnc2c1nc[nH]2)C.Cl.Cl
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: O=C(c1onc(n1)c1cc(Br)c(c(c1)Br)O)NCc1ccc(cc1)Oc1ccccc1
Complexity: __
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HeavyAtomCount: __
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MolecularFormula:
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MdlNumber:
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Smiles:
O=C(c1onc(n1)c1cc(Br)c(c(c1)Br)O)NCc1ccc(cc1)Oc1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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MolecularWeight: __
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Smiles: O=C1NC(=O)C(=C1c1c[nH]c2c1cccc2)c1c[nH]c2c1cccc2
Complexity: 576
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C1NC(=O)C(=C1c1c[nH]c2c1cccc2)c1c[nH]c2c1cccc2
Complexity:
576
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__