AA75882
150543-37-6 | 5-((Benzyloxy)carbonyl)-5-azaspiro[2.4]heptane-1-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AA75882
ChemicalName
5-((Benzyloxy)carbonyl)-5-azaspiro[2.4]heptane-1-carboxylic acid
CasNumber
150543-37-6
MolecularFormula
C15H17NO4
MolecularWeight
275.29978000000006
MdlNumber
MFCD12198827
Smiles
OC(=O)C1CC21CCN(C2)C(=O)OCc1ccccc1
Complexity
405
Covalently-bondedUnitCount
1
HeavyAtomCount
20
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
4
UndefinedAtomStereocenterCount
2
Xlogp3
1.5
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CatalogNumber: AA75882
ChemicalName: 5-((Benzyloxy)carbonyl)-5-azaspiro[2.4]heptane-1-carboxylic acid
CasNumber: 150543-37-6
MolecularFormula: C15H17NO4
MolecularWeight: 275.29978000000006
MdlNumber: MFCD12198827
Smiles: OC(=O)C1CC21CCN(C2)C(=O)OCc1ccccc1
Complexity: 405
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 4
UndefinedAtomStereocenterCount: 2
Xlogp3: 1.5
CatalogNumber:
AA75882
ChemicalName:
5-((Benzyloxy)carbonyl)-5-azaspiro[2.4]heptane-1-carboxylic acid
CasNumber:
150543-37-6
MolecularFormula:
C15H17NO4
MolecularWeight:
275.29978000000006
MdlNumber:
MFCD12198827
Smiles:
OC(=O)C1CC21CCN(C2)C(=O)OCc1ccccc1
Complexity:
405
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
4
UndefinedAtomStereocenterCount:
2
Xlogp3:
1.5
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Smiles: Nc1ccccc1Sc1c(C)n[nH]c1C
Complexity: __
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Smiles:
Nc1ccccc1Sc1c(C)n[nH]c1C
Complexity:
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HydrogenBondAcceptorCount:
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Smiles: CCn1c(SCC(=O)O)nnc1c1ccc(cc1)Cl
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Smiles:
CCn1c(SCC(=O)O)nnc1c1ccc(cc1)Cl
Complexity:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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UndefinedAtomStereocenterCount:
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Smiles: COC(=O)CC1CCc2c(N1)cccc2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
COC(=O)CC1CCc2c(N1)cccc2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__