AA65943
147610-85-3 | 6-(Benzyloxycarbonyl)-6-azaspiro[2.5]octane-1-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AA65943
ChemicalName
6-(Benzyloxycarbonyl)-6-azaspiro[2.5]octane-1-carboxylic acid
CasNumber
147610-85-3
MolecularFormula
C16H19NO4
MolecularWeight
289.32635999999997
MdlNumber
MFCD17214280
Smiles
O=C(N1CCC2(CC1)CC2C(=O)O)OCc1ccccc1
Complexity
409
Covalently-bondedUnitCount
1
HeavyAtomCount
21
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
4
UndefinedAtomStereocenterCount
1
Xlogp3
1.9
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CatalogNumber: AA65943
ChemicalName: 6-(Benzyloxycarbonyl)-6-azaspiro[2.5]octane-1-carboxylic acid
CasNumber: 147610-85-3
MolecularFormula: C16H19NO4
MolecularWeight: 289.32635999999997
MdlNumber: MFCD17214280
Smiles: O=C(N1CCC2(CC1)CC2C(=O)O)OCc1ccccc1
Complexity: 409
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 4
UndefinedAtomStereocenterCount: 1
Xlogp3: 1.9
CatalogNumber:
AA65943
ChemicalName:
6-(Benzyloxycarbonyl)-6-azaspiro[2.5]octane-1-carboxylic acid
CasNumber:
147610-85-3
MolecularFormula:
C16H19NO4
MolecularWeight:
289.32635999999997
MdlNumber:
MFCD17214280
Smiles:
O=C(N1CCC2(CC1)CC2C(=O)O)OCc1ccccc1
Complexity:
409
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
4
UndefinedAtomStereocenterCount:
1
Xlogp3:
1.9
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Smiles: CCOC(=O)C1CC21CCN(CC2)C(=O)OCc1ccccc1
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Smiles:
CCOC(=O)C1CC21CCN(CC2)C(=O)OCc1ccccc1
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Smiles: OCCc1ccccc1CN(C)C
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Smiles:
OCCc1ccccc1CN(C)C
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Smiles: N#CCC(=O)N1CCN(CC1)c1ccccc1
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
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__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
N#CCC(=O)N1CCN(CC1)c1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__