AA28619
1245643-13-3 | (R)-4-Benzyl-1-(tert-butoxycarbonyl)piperazine-2-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AA28619
ChemicalName
(R)-4-Benzyl-1-(tert-butoxycarbonyl)piperazine-2-carboxylic acid
CasNumber
1245643-13-3
MolecularFormula
C17H24N2O4
MolecularWeight
320.38345999999996
MdlNumber
MFCD12755495
Smiles
OC(=O)[C@H]1CN(CCN1C(=O)OC(C)(C)C)Cc1ccccc1
Complexity
427
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
1
HeavyAtomCount
23
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
5
Xlogp3
-0.2
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CatalogNumber: AA28619
ChemicalName: (R)-4-Benzyl-1-(tert-butoxycarbonyl)piperazine-2-carboxylic acid
CasNumber: 1245643-13-3
MolecularFormula: C17H24N2O4
MolecularWeight: 320.38345999999996
MdlNumber: MFCD12755495
Smiles: OC(=O)[C@H]1CN(CCN1C(=O)OC(C)(C)C)Cc1ccccc1
Complexity: 427
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 23
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 5
Xlogp3: -0.2
CatalogNumber:
AA28619
ChemicalName:
(R)-4-Benzyl-1-(tert-butoxycarbonyl)piperazine-2-carboxylic acid
CasNumber:
1245643-13-3
MolecularFormula:
C17H24N2O4
MolecularWeight:
320.38345999999996
MdlNumber:
MFCD12755495
Smiles:
OC(=O)[C@H]1CN(CCN1C(=O)OC(C)(C)C)Cc1ccccc1
Complexity:
427
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
23
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
5
Xlogp3:
-0.2
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Smiles: OC(=O)c1c(C)ccc2c1ccnc2Cl
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Smiles:
OC(=O)c1c(C)ccc2c1ccnc2Cl
Complexity:
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HeavyAtomCount:
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Smiles: CN1CCN(CC1)c1cccc(c1)Nc1ncc(c(=O)[nH]1)C
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Smiles:
CN1CCN(CC1)c1cccc(c1)Nc1ncc(c(=O)[nH]1)C
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DefinedAtomStereocenterCount:
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HydrogenBondDonorCount:
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Smiles: N[C@@H](c1noc(c1)C1CC1)C1CC1
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
N[C@@H](c1noc(c1)C1CC1)C1CC1
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
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