AB58557
883738-27-0 | 3-((4-Methylpiperazin-1-yl)methyl)phenylboronic acid, pinacol ester
Manufacturer: A2B Chem
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CatalogNumber
AB58557
ChemicalName
3-((4-Methylpiperazin-1-yl)methyl)phenylboronic acid, pinacol ester
CasNumber
883738-27-0
MolecularFormula
C18H29BN2O2
MolecularWeight
316.2461
MdlNumber
MFCD00060602
Smiles
CN1CCN(CC1)Cc1cccc(c1)B1OC(C(O1)(C)C)(C)C
Complexity
392
Covalently-bondedUnitCount
1
HeavyAtomCount
23
HydrogenBondAcceptorCount
4
RotatableBondCount
3
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CatalogNumber: AB58557
ChemicalName: 3-((4-Methylpiperazin-1-yl)methyl)phenylboronic acid, pinacol ester
CasNumber: 883738-27-0
MolecularFormula: C18H29BN2O2
MolecularWeight: 316.2461
MdlNumber: MFCD00060602
Smiles: CN1CCN(CC1)Cc1cccc(c1)B1OC(C(O1)(C)C)(C)C
Complexity: 392
Covalently-bondedUnitCount: 1
HeavyAtomCount: 23
HydrogenBondAcceptorCount: 4
RotatableBondCount: 3
CatalogNumber:
AB58557
ChemicalName:
3-((4-Methylpiperazin-1-yl)methyl)phenylboronic acid, pinacol ester
CasNumber:
883738-27-0
MolecularFormula:
C18H29BN2O2
MolecularWeight:
316.2461
MdlNumber:
MFCD00060602
Smiles:
CN1CCN(CC1)Cc1cccc(c1)B1OC(C(O1)(C)C)(C)C
Complexity:
392
Covalently-bondedUnitCount:
1
HeavyAtomCount:
23
HydrogenBondAcceptorCount:
4
RotatableBondCount:
3
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Smiles: CN1CCN(CC1)c1ncccc1C
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
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Smiles:
CN1CCN(CC1)c1ncccc1C
Complexity:
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HydrogenBondAcceptorCount:
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Smiles: OCC1=CCN(CC1)C
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Smiles:
OCC1=CCN(CC1)C
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HydrogenBondAcceptorCount:
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Smiles: Cc1ccc(cc1)S(=O)C
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MolecularFormula:
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MolecularWeight:
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Smiles:
Cc1ccc(cc1)S(=O)C
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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