AI54789
674792-04-2 | (R)-1-Boc-2-isopropyl-piperazine
Manufacturer: A2B Chem
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CatalogNumber
AI54789
ChemicalName
(R)-1-Boc-2-isopropyl-piperazine
CasNumber
674792-04-2
MolecularFormula
C12H24N2O2
MolecularWeight
228.3312
MdlNumber
MFCD07772101
Smiles
CC([C@@H]1CNCCN1C(=O)OC(C)(C)C)C
Complexity
246
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
1.9
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CatalogNumber: AI54789
ChemicalName: (R)-1-Boc-2-isopropyl-piperazine
CasNumber: 674792-04-2
MolecularFormula: C12H24N2O2
MolecularWeight: 228.3312
MdlNumber: MFCD07772101
Smiles: CC([C@@H]1CNCCN1C(=O)OC(C)(C)C)C
Complexity: 246
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 1.9
CatalogNumber:
AI54789
ChemicalName:
(R)-1-Boc-2-isopropyl-piperazine
CasNumber:
674792-04-2
MolecularFormula:
C12H24N2O2
MolecularWeight:
228.3312
MdlNumber:
MFCD07772101
Smiles:
CC([C@@H]1CNCCN1C(=O)OC(C)(C)C)C
Complexity:
246
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
1.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C1=CC=C(C=C1)COC(=O)C2=CC=C(C=C2)Cl
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
C1=CC=C(C=C1)COC(=O)C2=CC=C(C=C2)Cl
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC1(C)CNC(=NC1)N/N=C(C=Cc1ccc(cc1)C(F)(F)F)/C=C/c1ccc(cc1)C(F)(F)F
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC1(C)CNC(=NC1)N/N=C(C=Cc1ccc(cc1)C(F)(F)F)/C=C/c1ccc(cc1)C(F)(F)F
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)[C@@H]1C[C@]21C(=O)Nc1c2cccc1
Complexity: 368
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 1
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOC(=O)[C@@H]1C[C@]21C(=O)Nc1c2cccc1
Complexity:
368
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
1