AE27132
1086394-61-7 | Benzyl 2,9-diazaspiro[5.5]undecane-2-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AE27132
ChemicalName
Benzyl 2,9-diazaspiro[5.5]undecane-2-carboxylate
CasNumber
1086394-61-7
MolecularFormula
C17H24N2O2
MolecularWeight
288.3847
MdlNumber
MFCD11223509
Smiles
O=C(N1CCCC2(C1)CCNCC2)OCc1ccccc1
Complexity
347
Covalently-bondedUnitCount
1
HeavyAtomCount
21
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
2.3
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CatalogNumber: AE27132
ChemicalName: Benzyl 2,9-diazaspiro[5.5]undecane-2-carboxylate
CasNumber: 1086394-61-7
MolecularFormula: C17H24N2O2
MolecularWeight: 288.3847
MdlNumber: MFCD11223509
Smiles: O=C(N1CCCC2(C1)CCNCC2)OCc1ccccc1
Complexity: 347
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 2.3
CatalogNumber:
AE27132
ChemicalName:
Benzyl 2,9-diazaspiro[5.5]undecane-2-carboxylate
CasNumber:
1086394-61-7
MolecularFormula:
C17H24N2O2
MolecularWeight:
288.3847
MdlNumber:
MFCD11223509
Smiles:
O=C(N1CCCC2(C1)CCNCC2)OCc1ccccc1
Complexity:
347
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
2.3
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Smiles: CCN([C@H]1CNCC1)CC
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Smiles:
CCN([C@H]1CNCC1)CC
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Smiles: OCC1CN(CC1N)C(=O)OC(C)(C)C
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OCC1CN(CC1N)C(=O)OC(C)(C)C
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Smiles: CCC[C@@H](B1O[C@H]2[C@](O1)(C)[C@H]1C[C@@H](C2)C1(C)C)N
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Smiles:
CCC[C@@H](B1O[C@H]2[C@](O1)(C)[C@H]1C[C@@H](C2)C1(C)C)N
Complexity:
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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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