AI30785
1341037-07-7 | 6-Oxo-2,7,11-triaza-dispiro[3.0.4.3]dodecane-2-carboxylic acid tert-butyl ester
Manufacturer: A2B Chem
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CatalogNumber
AI30785
ChemicalName
6-Oxo-2,7,11-triaza-dispiro[3.0.4.3]dodecane-2-carboxylic acid tert-butyl ester
CasNumber
1341037-07-7
MolecularFormula
C14H23N3O3
MolecularWeight
281.35071999999997
MdlNumber
MFCD21362264
Smiles
O=C(N1CC2(C1)CNCC12CCNC1=O)OC(C)(C)C
Complexity
451
Covalently-bondedUnitCount
1
HeavyAtomCount
20
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
2
UndefinedAtomStereocenterCount
1
Xlogp3
-0.4
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CatalogNumber: AI30785
ChemicalName: 6-Oxo-2,7,11-triaza-dispiro[3.0.4.3]dodecane-2-carboxylic acid tert-butyl ester
CasNumber: 1341037-07-7
MolecularFormula: C14H23N3O3
MolecularWeight: 281.35071999999997
MdlNumber: MFCD21362264
Smiles: O=C(N1CC2(C1)CNCC12CCNC1=O)OC(C)(C)C
Complexity: 451
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 2
UndefinedAtomStereocenterCount: 1
Xlogp3: -0.4
CatalogNumber:
AI30785
ChemicalName:
6-Oxo-2,7,11-triaza-dispiro[3.0.4.3]dodecane-2-carboxylic acid tert-butyl ester
CasNumber:
1341037-07-7
MolecularFormula:
C14H23N3O3
MolecularWeight:
281.35071999999997
MdlNumber:
MFCD21362264
Smiles:
O=C(N1CC2(C1)CNCC12CCNC1=O)OC(C)(C)C
Complexity:
451
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
2
UndefinedAtomStereocenterCount:
1
Xlogp3:
-0.4
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MolecularFormula: __
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Smiles: NC1CCC2(C1)CCN(C2)C(=O)OC(C)(C)C
Complexity: __
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Smiles:
NC1CCC2(C1)CCN(C2)C(=O)OC(C)(C)C
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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UndefinedAtomStereocenterCount:
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Smiles: CCOC(=O)c1cnc2n1CCN(CC2)C(=O)OC(C)(C)C
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Smiles:
CCOC(=O)c1cnc2n1CCN(CC2)C(=O)OC(C)(C)C
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Smiles: COc1ccc(nc1N)c1ccccn1
Complexity: __
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Smiles:
COc1ccc(nc1N)c1ccccn1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
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