AC10796
883738-38-3 | 3-(4-Methylpiperazine-1-carbonyl)phenylboronic acid, pinacol ester
Manufacturer: A2B Chem
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CatalogNumber
AC10796
ChemicalName
3-(4-Methylpiperazine-1-carbonyl)phenylboronic acid, pinacol ester
CasNumber
883738-38-3
MolecularFormula
C18H27BN2O3
MolecularWeight
330.2296
MdlNumber
MFCD05864308
Smiles
CN1CCN(CC1)C(=O)c1cccc(c1)B1OC(C(O1)(C)C)(C)C
Complexity
459
Covalently-bondedUnitCount
1
HeavyAtomCount
24
HydrogenBondAcceptorCount
4
RotatableBondCount
2
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CatalogNumber: AC10796
ChemicalName: 3-(4-Methylpiperazine-1-carbonyl)phenylboronic acid, pinacol ester
CasNumber: 883738-38-3
MolecularFormula: C18H27BN2O3
MolecularWeight: 330.2296
MdlNumber: MFCD05864308
Smiles: CN1CCN(CC1)C(=O)c1cccc(c1)B1OC(C(O1)(C)C)(C)C
Complexity: 459
Covalently-bondedUnitCount: 1
HeavyAtomCount: 24
HydrogenBondAcceptorCount: 4
RotatableBondCount: 2
CatalogNumber:
AC10796
ChemicalName:
3-(4-Methylpiperazine-1-carbonyl)phenylboronic acid, pinacol ester
CasNumber:
883738-38-3
MolecularFormula:
C18H27BN2O3
MolecularWeight:
330.2296
MdlNumber:
MFCD05864308
Smiles:
CN1CCN(CC1)C(=O)c1cccc(c1)B1OC(C(O1)(C)C)(C)C
Complexity:
459
Covalently-bondedUnitCount:
1
HeavyAtomCount:
24
HydrogenBondAcceptorCount:
4
RotatableBondCount:
2
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Smiles: CC(c1nnc(s1)Br)(C)C
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Smiles:
CC(c1nnc(s1)Br)(C)C
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Smiles: COc1cc(ccc1OC)c1oc2c(c1Br)nc1c(n2)cccc1
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Smiles:
COc1cc(ccc1OC)c1oc2c(c1Br)nc1c(n2)cccc1
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HydrogenBondAcceptorCount:
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Smiles: CC(=CCC/C(=C/CC1=C(C)C(=O)c2c(C1=O)cccc2)/C)CC/C=C(/CCC=C(C)C)\C
Complexity: __
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MolecularFormula:
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MolecularWeight:
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Smiles:
CC(=CCC/C(=C/CC1=C(C)C(=O)c2c(C1=O)cccc2)/C)CC/C=C(/CCC=C(C)C)\C
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
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