AA93115
174855-57-3 | 4-(2-Formylphenyl)piperazine-1-carboxylic acid tert-butyl ester
Manufacturer: A2B Chem
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CatalogNumber
AA93115
ChemicalName
4-(2-Formylphenyl)piperazine-1-carboxylic acid tert-butyl ester
CasNumber
174855-57-3
MolecularFormula
C16H22N2O3
MolecularWeight
290.3575
MdlNumber
MFCD05864664
Smiles
O=Cc1ccccc1N1CCN(CC1)C(=O)OC(C)(C)C
Complexity
370
Covalently-bondedUnitCount
1
HeavyAtomCount
21
HydrogenBondAcceptorCount
4
RotatableBondCount
4
Xlogp3
2.2
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CatalogNumber: AA93115
ChemicalName: 4-(2-Formylphenyl)piperazine-1-carboxylic acid tert-butyl ester
CasNumber: 174855-57-3
MolecularFormula: C16H22N2O3
MolecularWeight: 290.3575
MdlNumber: MFCD05864664
Smiles: O=Cc1ccccc1N1CCN(CC1)C(=O)OC(C)(C)C
Complexity: 370
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 4
RotatableBondCount: 4
Xlogp3: 2.2
CatalogNumber:
AA93115
ChemicalName:
4-(2-Formylphenyl)piperazine-1-carboxylic acid tert-butyl ester
CasNumber:
174855-57-3
MolecularFormula:
C16H22N2O3
MolecularWeight:
290.3575
MdlNumber:
MFCD05864664
Smiles:
O=Cc1ccccc1N1CCN(CC1)C(=O)OC(C)(C)C
Complexity:
370
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
4
RotatableBondCount:
4
Xlogp3:
2.2
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Smiles: NCc1ccccc1N1CCN(CC1)C(=O)OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
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Smiles:
NCc1ccccc1N1CCN(CC1)C(=O)OC(C)(C)C
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HydrogenBondAcceptorCount:
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Smiles: Nc1cccc2c1cc[nH]2.Cl
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Smiles:
Nc1cccc2c1cc[nH]2.Cl
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RotatableBondCount:
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Smiles: Sc1ccc(cc1)C#Cc1ccc(cc1)C#Cc1ccccc1
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__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
Sc1ccc(cc1)C#Cc1ccc(cc1)C#Cc1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
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