AH93044
914349-64-7 | 1-[Bis(4-fluorophenyl)methyl]-4-(4-nitrobenzyl)piperazine
Manufacturer: A2B Chem
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CatalogNumber
AH93044
ChemicalName
1-[Bis(4-fluorophenyl)methyl]-4-(4-nitrobenzyl)piperazine
CasNumber
914349-64-7
MolecularFormula
C24H23F2N3O2
MolecularWeight
423.4551
MdlNumber
MFCD06797793
Smiles
Fc1ccc(cc1)C(c1ccc(cc1)F)N1CCN(CC1)Cc1ccc(cc1)[N+](=O)[O-]
Complexity
536
Covalently-bondedUnitCount
1
HeavyAtomCount
31
HydrogenBondAcceptorCount
6
RotatableBondCount
5
Xlogp3
4.8
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CatalogNumber: AH93044
ChemicalName: 1-[Bis(4-fluorophenyl)methyl]-4-(4-nitrobenzyl)piperazine
CasNumber: 914349-64-7
MolecularFormula: C24H23F2N3O2
MolecularWeight: 423.4551
MdlNumber: MFCD06797793
Smiles: Fc1ccc(cc1)C(c1ccc(cc1)F)N1CCN(CC1)Cc1ccc(cc1)[N+](=O)[O-]
Complexity: 536
Covalently-bondedUnitCount: 1
HeavyAtomCount: 31
HydrogenBondAcceptorCount: 6
RotatableBondCount: 5
Xlogp3: 4.8
CatalogNumber:
AH93044
ChemicalName:
1-[Bis(4-fluorophenyl)methyl]-4-(4-nitrobenzyl)piperazine
CasNumber:
914349-64-7
MolecularFormula:
C24H23F2N3O2
MolecularWeight:
423.4551
MdlNumber:
MFCD06797793
Smiles:
Fc1ccc(cc1)C(c1ccc(cc1)F)N1CCN(CC1)Cc1ccc(cc1)[N+](=O)[O-]
Complexity:
536
Covalently-bondedUnitCount:
1
HeavyAtomCount:
31
HydrogenBondAcceptorCount:
6
RotatableBondCount:
5
Xlogp3:
4.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: [O-][N+](=O)c1ccc(c(c1)C(F)(F)F)N1CCc2c(C1)cccc2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
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ChemicalName:
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MolecularFormula:
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MolecularWeight:
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Smiles:
[O-][N+](=O)c1ccc(c(c1)C(F)(F)F)N1CCc2c(C1)cccc2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
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RotatableBondCount:
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Xlogp3:
__
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ChemicalName: __
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MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COCCCNC1CCCN(C1)C(=O)OC(C)(C)C
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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Xlogp3: __
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CasNumber:
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MolecularWeight:
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Smiles:
COCCCNC1CCCN(C1)C(=O)OC(C)(C)C
Complexity:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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Xlogp3:
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CatalogNumber: AH93049
ChemicalName: 2-(2-Aminopyrimidin-5-yl)benzaldehyde
CasNumber: 914349-52-3
MolecularFormula: C11H9N3O
MolecularWeight: 199.2087
MdlNumber: MFCD05864832
Smiles: O=Cc1ccccc1c1cnc(nc1)N
Complexity: 214
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
RotatableBondCount: 2
Xlogp3: 0.9
CatalogNumber:
AH93049
ChemicalName:
2-(2-Aminopyrimidin-5-yl)benzaldehyde
CasNumber:
914349-52-3
MolecularFormula:
C11H9N3O
MolecularWeight:
199.2087
MdlNumber:
MFCD05864832
Smiles:
O=Cc1ccccc1c1cnc(nc1)N
Complexity:
214
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
RotatableBondCount:
2
Xlogp3:
0.9