AF61130
268550-48-7 | tert-Butyl 1-oxo-2,8-diazaspiro[4.5]decane-8-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AF61130
ChemicalName
tert-Butyl 1-oxo-2,8-diazaspiro[4.5]decane-8-carboxylate
CasNumber
268550-48-7
MolecularFormula
C13H22N2O3
MolecularWeight
254.3254
MdlNumber
MFCD08461248
Smiles
O=C(N1CCC2(CC1)CCNC2=O)OC(C)(C)C
Complexity
352
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
0.8
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CatalogNumber: AF61130
ChemicalName: tert-Butyl 1-oxo-2,8-diazaspiro[4.5]decane-8-carboxylate
CasNumber: 268550-48-7
MolecularFormula: C13H22N2O3
MolecularWeight: 254.3254
MdlNumber: MFCD08461248
Smiles: O=C(N1CCC2(CC1)CCNC2=O)OC(C)(C)C
Complexity: 352
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 0.8
CatalogNumber:
AF61130
ChemicalName:
tert-Butyl 1-oxo-2,8-diazaspiro[4.5]decane-8-carboxylate
CasNumber:
268550-48-7
MolecularFormula:
C13H22N2O3
MolecularWeight:
254.3254
MdlNumber:
MFCD08461248
Smiles:
O=C(N1CCC2(CC1)CCNC2=O)OC(C)(C)C
Complexity:
352
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
0.8
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Smiles: OC(=O)COC1CCCN(C1)C(=O)OC(C)(C)C
Complexity: __
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Smiles:
OC(=O)COC1CCCN(C1)C(=O)OC(C)(C)C
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HeavyAtomCount:
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Smiles: COC1=CC=CC2=C1OC3=C(C2=O)C(=CC(=C3OC)OC)O
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Smiles:
COC1=CC=CC2=C1OC3=C(C2=O)C(=CC(=C3OC)OC)O
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Smiles: Nc1nc2ccccc2c(c1)C(F)(F)F
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Smiles:
Nc1nc2ccccc2c(c1)C(F)(F)F
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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