AE46524
1160247-10-8 | 6-Benzyl 2-tert-butyl 2,6,9-triazaspiro-[4.5]decane-2,6-dicarboxylate
Manufacturer: A2B Chem
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CatalogNumber
AE46524
ChemicalName
6-Benzyl 2-tert-butyl 2,6,9-triazaspiro-[4.5]decane-2,6-dicarboxylate
CasNumber
1160247-10-8
MolecularFormula
C20H29N3O4
MolecularWeight
375.4619599999999
MdlNumber
MFCD12198546
Smiles
O=C(N1CCNCC21CCN(C2)C(=O)OC(C)(C)C)OCc1ccccc1
Complexity
542
Covalently-bondedUnitCount
1
HeavyAtomCount
27
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
5
UndefinedAtomStereocenterCount
1
Xlogp3
1.9
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CatalogNumber: AE46524
ChemicalName: 6-Benzyl 2-tert-butyl 2,6,9-triazaspiro-[4.5]decane-2,6-dicarboxylate
CasNumber: 1160247-10-8
MolecularFormula: C20H29N3O4
MolecularWeight: 375.4619599999999
MdlNumber: MFCD12198546
Smiles: O=C(N1CCNCC21CCN(C2)C(=O)OC(C)(C)C)OCc1ccccc1
Complexity: 542
Covalently-bondedUnitCount: 1
HeavyAtomCount: 27
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 5
UndefinedAtomStereocenterCount: 1
Xlogp3: 1.9
CatalogNumber:
AE46524
ChemicalName:
6-Benzyl 2-tert-butyl 2,6,9-triazaspiro-[4.5]decane-2,6-dicarboxylate
CasNumber:
1160247-10-8
MolecularFormula:
C20H29N3O4
MolecularWeight:
375.4619599999999
MdlNumber:
MFCD12198546
Smiles:
O=C(N1CCNCC21CCN(C2)C(=O)OC(C)(C)C)OCc1ccccc1
Complexity:
542
Covalently-bondedUnitCount:
1
HeavyAtomCount:
27
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
5
UndefinedAtomStereocenterCount:
1
Xlogp3:
1.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(N1CCCC2(CC1)CCCN2)OCc1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(N1CCCC2(CC1)CCCN2)OCc1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OCC(C(=O)O)NCc1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OCC(C(=O)O)NCc1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: AE46528
ChemicalName: 1'-Benzyl 1-tert-butyl 5-fluorospiro[indoline-3,4'-piperidine]-1,1'-dicarboxylate
CasNumber: 1201649-36-6
MolecularFormula: C25H29FN2O4
MolecularWeight: 440.5072
MdlNumber: MFCD22377065
Smiles: Fc1ccc2c(c1)C1(CCN(CC1)C(=O)OCc1ccccc1)CN2C(=O)OC(C)(C)C
Complexity: 680
Covalently-bondedUnitCount: 1
HeavyAtomCount: 32
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: __
RotatableBondCount: 5
UndefinedAtomStereocenterCount: __
Xlogp3: 4.5
CatalogNumber:
AE46528
ChemicalName:
1'-Benzyl 1-tert-butyl 5-fluorospiro[indoline-3,4'-piperidine]-1,1'-dicarboxylate
CasNumber:
1201649-36-6
MolecularFormula:
C25H29FN2O4
MolecularWeight:
440.5072
MdlNumber:
MFCD22377065
Smiles:
Fc1ccc2c(c1)C1(CCN(CC1)C(=O)OCc1ccccc1)CN2C(=O)OC(C)(C)C
Complexity:
680
Covalently-bondedUnitCount:
1
HeavyAtomCount:
32
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
__
RotatableBondCount:
5
UndefinedAtomStereocenterCount:
__
Xlogp3:
4.5