AC28537
864754-07-4 | 4-(Piperazine-1-carbonyl)phenylboronic acid, pinacol ester
Manufacturer: A2B Chem
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CatalogNumber
AC28537
ChemicalName
4-(Piperazine-1-carbonyl)phenylboronic acid, pinacol ester
CasNumber
864754-07-4
MolecularFormula
C17H25BN2O3
MolecularWeight
316.203
MdlNumber
MFCD06657704
Smiles
O=C(c1ccc(cc1)B1OC(C(O1)(C)C)(C)C)N1CCNCC1
Complexity
425
Covalently-bondedUnitCount
1
HeavyAtomCount
23
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
2
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CatalogNumber: AC28537
ChemicalName: 4-(Piperazine-1-carbonyl)phenylboronic acid, pinacol ester
CasNumber: 864754-07-4
MolecularFormula: C17H25BN2O3
MolecularWeight: 316.203
MdlNumber: MFCD06657704
Smiles: O=C(c1ccc(cc1)B1OC(C(O1)(C)C)(C)C)N1CCNCC1
Complexity: 425
Covalently-bondedUnitCount: 1
HeavyAtomCount: 23
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 2
CatalogNumber:
AC28537
ChemicalName:
4-(Piperazine-1-carbonyl)phenylboronic acid, pinacol ester
CasNumber:
864754-07-4
MolecularFormula:
C17H25BN2O3
MolecularWeight:
316.203
MdlNumber:
MFCD06657704
Smiles:
O=C(c1ccc(cc1)B1OC(C(O1)(C)C)(C)C)N1CCNCC1
Complexity:
425
Covalently-bondedUnitCount:
1
HeavyAtomCount:
23
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
2
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MolecularFormula: __
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Smiles: Brc1cccc(c1)c1csc(n1)COc1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
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Smiles:
Brc1cccc(c1)c1csc(n1)COc1ccccc1
Complexity:
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Covalently-bondedUnitCount:
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__
HydrogenBondAcceptorCount:
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Smiles: CCOC(COc1ccc(cc1)SC(F)(F)F)OCC
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Smiles:
CCOC(COc1ccc(cc1)SC(F)(F)F)OCC
Complexity:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: Clc1cccc(c1)C1CSCCN1
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Clc1cccc(c1)C1CSCCN1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__