AC55403
82205-58-1 | 1-(5-Nitropyridin-2-yl)piperazine
Manufacturer: A2B Chem
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CatalogNumber
AC55403
ChemicalName
1-(5-Nitropyridin-2-yl)piperazine
CasNumber
82205-58-1
MolecularFormula
C9H12N4O2
MolecularWeight
208.2172
MdlNumber
MFCD00053059
Smiles
[O-][N+](=O)c1ccc(nc1)N1CCNCC1
Complexity
225
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
0.5
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CatalogNumber: AC55403
ChemicalName: 1-(5-Nitropyridin-2-yl)piperazine
CasNumber: 82205-58-1
MolecularFormula: C9H12N4O2
MolecularWeight: 208.2172
MdlNumber: MFCD00053059
Smiles: [O-][N+](=O)c1ccc(nc1)N1CCNCC1
Complexity: 225
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 0.5
CatalogNumber:
AC55403
ChemicalName:
1-(5-Nitropyridin-2-yl)piperazine
CasNumber:
82205-58-1
MolecularFormula:
C9H12N4O2
MolecularWeight:
208.2172
MdlNumber:
MFCD00053059
Smiles:
[O-][N+](=O)c1ccc(nc1)N1CCNCC1
Complexity:
225
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
0.5
CatalogNumber: __
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MolecularFormula: __
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Smiles: CCCCCCCCCCCC(=O)N[C@H](C(=O)OCC(CCCCCCCCCC)CCCCCCCC)CCC(=O)OCC(CCCCCCCCCC)CCCCCCCC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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RotatableBondCount: __
Xlogp3: __
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Smiles:
CCCCCCCCCCCC(=O)N[C@H](C(=O)OCC(CCCCCCCCCC)CCCCCCCC)CCC(=O)OCC(CCCCCCCCCC)CCCCCCCC
Complexity:
__
Covalently-bondedUnitCount:
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RotatableBondCount:
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Xlogp3:
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Smiles: CCCCCCCCCCCCCCCCCC(=O)OC(=O)[C@H](CCC(=O)[O-])N.[Na+]
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
CCCCCCCCCCCCCCCCCC(=O)OC(=O)[C@H](CCC(=O)[O-])N.[Na+]
Complexity:
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Covalently-bondedUnitCount:
__
HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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MolecularFormula: __
MolecularWeight: __
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Smiles: O=C1OC(=O)C(C1)(F)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C1OC(=O)C(C1)(F)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__