AI30259
1330765-76-8 | tert-Butyl 5-oxo-6,7-dihydro-5h-spiro[[1,6]naphthyridine-8,4'-piperidine]-1'-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AI30259
ChemicalName
tert-Butyl 5-oxo-6,7-dihydro-5h-spiro[[1,6]naphthyridine-8,4'-piperidine]-1'-carboxylate
CasNumber
1330765-76-8
MolecularFormula
C17H23N3O3
MolecularWeight
317.3828
MdlNumber
MFCD20230714
Smiles
O=C(N1CCC2(CC1)CNC(=O)c1c2nccc1)OC(C)(C)C
Complexity
478
Covalently-bondedUnitCount
1
HeavyAtomCount
23
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
1.4
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CatalogNumber: AI30259
ChemicalName: tert-Butyl 5-oxo-6,7-dihydro-5h-spiro[[1,6]naphthyridine-8,4'-piperidine]-1'-carboxylate
CasNumber: 1330765-76-8
MolecularFormula: C17H23N3O3
MolecularWeight: 317.3828
MdlNumber: MFCD20230714
Smiles: O=C(N1CCC2(CC1)CNC(=O)c1c2nccc1)OC(C)(C)C
Complexity: 478
Covalently-bondedUnitCount: 1
HeavyAtomCount: 23
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 1.4
CatalogNumber:
AI30259
ChemicalName:
tert-Butyl 5-oxo-6,7-dihydro-5h-spiro[[1,6]naphthyridine-8,4'-piperidine]-1'-carboxylate
CasNumber:
1330765-76-8
MolecularFormula:
C17H23N3O3
MolecularWeight:
317.3828
MdlNumber:
MFCD20230714
Smiles:
O=C(N1CCC2(CC1)CNC(=O)c1c2nccc1)OC(C)(C)C
Complexity:
478
Covalently-bondedUnitCount:
1
HeavyAtomCount:
23
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
1.4
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Smiles: ClCc1cc(=O)n2c(n1)CN(CCC2)C(=O)OC(C)(C)C
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ClCc1cc(=O)n2c(n1)CN(CCC2)C(=O)OC(C)(C)C
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Smiles: O=C(N1C[C@@H]([C@]2(C1)CNCC2)c1ccccc1)OC(C)(C)C
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Smiles:
O=C(N1C[C@@H]([C@]2(C1)CNCC2)c1ccccc1)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
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RotatableBondCount:
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MdlNumber:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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