AB56542
51639-48-6 | 1-(4-Acetylphenyl)piperazine
Manufacturer: A2B Chem
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CatalogNumber
AB56542
ChemicalName
1-(4-Acetylphenyl)piperazine
CasNumber
51639-48-6
MolecularFormula
C12H16N2O
MolecularWeight
204.2682
MdlNumber
MFCD00005962
Smiles
CC(=O)c1ccc(cc1)N1CCNCC1
NscNumber
109890
Complexity
216
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
2
UndefinedAtomStereocenterCount
1
Xlogp3
0.9
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CatalogNumber: AB56542
ChemicalName: 1-(4-Acetylphenyl)piperazine
CasNumber: 51639-48-6
MolecularFormula: C12H16N2O
MolecularWeight: 204.2682
MdlNumber: MFCD00005962
Smiles: CC(=O)c1ccc(cc1)N1CCNCC1
NscNumber: 109890
Complexity: 216
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
UndefinedAtomStereocenterCount: 1
Xlogp3: 0.9
CatalogNumber:
AB56542
ChemicalName:
1-(4-Acetylphenyl)piperazine
CasNumber:
51639-48-6
MolecularFormula:
C12H16N2O
MolecularWeight:
204.2682
MdlNumber:
MFCD00005962
Smiles:
CC(=O)c1ccc(cc1)N1CCNCC1
NscNumber:
109890
Complexity:
216
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
UndefinedAtomStereocenterCount:
1
Xlogp3:
0.9
CatalogNumber: __
ChemicalName: __
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MolecularFormula: __
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Smiles: CCCCC[C@@H]1CC[C@H](CC1)c1ccc(cc1)C(=O)C
NscNumber: __
Complexity: __
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HydrogenBondAcceptorCount: __
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RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
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MolecularFormula:
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Smiles:
CCCCC[C@@H]1CC[C@H](CC1)c1ccc(cc1)C(=O)C
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
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ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)C1CCCN(C1)CCC=C(c1ccccc1)c1ccccc1.Cl
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
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__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
OC(=O)C1CCCN(C1)CCC=C(c1ccccc1)c1ccccc1.Cl
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
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CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1cc2nc(nc(c2cc1OC)N)N1CCN(CC1)C(=O)C1CCCO1.Cl.O.O
NscNumber: __
Complexity: 544
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1cc2nc(nc(c2cc1OC)N)N1CCN(CC1)C(=O)C1CCCO1.Cl.O.O
NscNumber:
__
Complexity:
544
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__