AG70886
628326-05-6 | 1-Boc-4-(4-bromo-2-formylphenyl)piperazine
Manufacturer: A2B Chem
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CatalogNumber
AG70886
ChemicalName
1-Boc-4-(4-bromo-2-formylphenyl)piperazine
CasNumber
628326-05-6
MolecularFormula
C16H21BrN2O3
MolecularWeight
369.2535
MdlNumber
MFCD09817615
Smiles
O=Cc1cc(Br)ccc1N1CCN(CC1)C(=O)OC(C)(C)C
Complexity
403
Covalently-bondedUnitCount
1
HeavyAtomCount
22
HydrogenBondAcceptorCount
4
RotatableBondCount
4
Xlogp3
2.9
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CatalogNumber: AG70886
ChemicalName: 1-Boc-4-(4-bromo-2-formylphenyl)piperazine
CasNumber: 628326-05-6
MolecularFormula: C16H21BrN2O3
MolecularWeight: 369.2535
MdlNumber: MFCD09817615
Smiles: O=Cc1cc(Br)ccc1N1CCN(CC1)C(=O)OC(C)(C)C
Complexity: 403
Covalently-bondedUnitCount: 1
HeavyAtomCount: 22
HydrogenBondAcceptorCount: 4
RotatableBondCount: 4
Xlogp3: 2.9
CatalogNumber:
AG70886
ChemicalName:
1-Boc-4-(4-bromo-2-formylphenyl)piperazine
CasNumber:
628326-05-6
MolecularFormula:
C16H21BrN2O3
MolecularWeight:
369.2535
MdlNumber:
MFCD09817615
Smiles:
O=Cc1cc(Br)ccc1N1CCN(CC1)C(=O)OC(C)(C)C
Complexity:
403
Covalently-bondedUnitCount:
1
HeavyAtomCount:
22
HydrogenBondAcceptorCount:
4
RotatableBondCount:
4
Xlogp3:
2.9
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Smiles: CCOC(=O)C(=O)c1ccc(cc1)CC
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
CCOC(=O)C(=O)c1ccc(cc1)CC
Complexity:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: CCN(CC)CC1=CC(=C(O1)C2=CC=CC=C2)C(=O)O
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Smiles:
CCN(CC)CC1=CC(=C(O1)C2=CC=CC=C2)C(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
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Smiles: OC(=O)c1n[nH]c2c1CC(CC2)C(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)c1n[nH]c2c1CC(CC2)C(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__