AB51555
170011-57-1 | 4-(4-Amino-phenyl)-piperidine-1-carboxylic acid tert-butyl ester
Manufacturer: A2B Chem
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CatalogNumber
AB51555
ChemicalName
4-(4-Amino-phenyl)-piperidine-1-carboxylic acid tert-butyl ester
CasNumber
170011-57-1
MolecularFormula
C16H24N2O2
MolecularWeight
276.374
MdlNumber
MFCD05861405
Smiles
O=C(N1CCC(CC1)c1ccc(cc1)N)OC(C)(C)C
Complexity
322
Covalently-bondedUnitCount
1
HeavyAtomCount
20
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
2.7
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CatalogNumber: AB51555
ChemicalName: 4-(4-Amino-phenyl)-piperidine-1-carboxylic acid tert-butyl ester
CasNumber: 170011-57-1
MolecularFormula: C16H24N2O2
MolecularWeight: 276.374
MdlNumber: MFCD05861405
Smiles: O=C(N1CCC(CC1)c1ccc(cc1)N)OC(C)(C)C
Complexity: 322
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 2.7
CatalogNumber:
AB51555
ChemicalName:
4-(4-Amino-phenyl)-piperidine-1-carboxylic acid tert-butyl ester
CasNumber:
170011-57-1
MolecularFormula:
C16H24N2O2
MolecularWeight:
276.374
MdlNumber:
MFCD05861405
Smiles:
O=C(N1CCC(CC1)c1ccc(cc1)N)OC(C)(C)C
Complexity:
322
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
2.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC[C@H](Cn1ccc(nc1=O)N)OCP(=O)(O)O
Complexity: 417
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: -3.6
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
OC[C@H](Cn1ccc(nc1=O)N)OCP(=O)(O)O
Complexity:
417
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
-3.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Ic1ccc(c(c1)C(=O)c1ccc(cc1)O[C@@H]1COCC1)Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Ic1ccc(c(c1)C(=O)c1ccc(cc1)O[C@@H]1COCC1)Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=Cc1cc(ccc1[N+](=O)[O-])C(F)(F)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=Cc1cc(ccc1[N+](=O)[O-])C(F)(F)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__