AA54010
1217599-13-7 | (R)-1-Boc-2-isobutyl-piperazine
Manufacturer: A2B Chem
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CatalogNumber
AA54010
ChemicalName
(R)-1-Boc-2-isobutyl-piperazine
CasNumber
1217599-13-7
MolecularFormula
C13H26N2O2
MolecularWeight
242.3577
MdlNumber
MFCD07772099
Smiles
CC(C[C@@H]1CNCCN1C(=O)OC(C)(C)C)C
Complexity
259
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
4
Xlogp3
2.2
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CatalogNumber: AA54010
ChemicalName: (R)-1-Boc-2-isobutyl-piperazine
CasNumber: 1217599-13-7
MolecularFormula: C13H26N2O2
MolecularWeight: 242.3577
MdlNumber: MFCD07772099
Smiles: CC(C[C@@H]1CNCCN1C(=O)OC(C)(C)C)C
Complexity: 259
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 4
Xlogp3: 2.2
CatalogNumber:
AA54010
ChemicalName:
(R)-1-Boc-2-isobutyl-piperazine
CasNumber:
1217599-13-7
MolecularFormula:
C13H26N2O2
MolecularWeight:
242.3577
MdlNumber:
MFCD07772099
Smiles:
CC(C[C@@H]1CNCCN1C(=O)OC(C)(C)C)C
Complexity:
259
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
4
Xlogp3:
2.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)[C@H]1CNCCN1C(=O)OCc1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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__
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MolecularFormula:
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Smiles:
COC(=O)[C@H]1CNCCN1C(=O)OCc1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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CasNumber: __
MolecularFormula: __
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Smiles: Cc1ccc(cc1)S(=O)(=O)N[C@@H]([C@@H](c1ccccc1)NS(=O)(=O)c1ccc(cc1)C)c1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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MolecularFormula:
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Smiles:
Cc1ccc(cc1)S(=O)(=O)N[C@@H]([C@@H](c1ccccc1)NS(=O)(=O)c1ccc(cc1)C)c1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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ChemicalName: __
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MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Fc1ccc(c(c1)[C@@H]1CCCN1)F
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Fc1ccc(c(c1)[C@@H]1CCCN1)F
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__