AI10108
1160247-71-1 | tert-Butyl 2'-oxo-2',4'-dihydro-1'h-spiro[pyrrolidine-3,3'-quinoline]-1-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AI10108
ChemicalName
tert-Butyl 2'-oxo-2',4'-dihydro-1'h-spiro[pyrrolidine-3,3'-quinoline]-1-carboxylate
CasNumber
1160247-71-1
MolecularFormula
C17H22N2O3
MolecularWeight
302.36818000000005
MdlNumber
MFCD12198632
Smiles
O=C(N1CCC2(C1)Cc1ccccc1NC2=O)OC(C)(C)C
Complexity
471
Covalently-bondedUnitCount
1
HeavyAtomCount
22
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
2
UndefinedAtomStereocenterCount
1
Xlogp3
1.9
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CatalogNumber: AI10108
ChemicalName: tert-Butyl 2'-oxo-2',4'-dihydro-1'h-spiro[pyrrolidine-3,3'-quinoline]-1-carboxylate
CasNumber: 1160247-71-1
MolecularFormula: C17H22N2O3
MolecularWeight: 302.36818000000005
MdlNumber: MFCD12198632
Smiles: O=C(N1CCC2(C1)Cc1ccccc1NC2=O)OC(C)(C)C
Complexity: 471
Covalently-bondedUnitCount: 1
HeavyAtomCount: 22
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
UndefinedAtomStereocenterCount: 1
Xlogp3: 1.9
CatalogNumber:
AI10108
ChemicalName:
tert-Butyl 2'-oxo-2',4'-dihydro-1'h-spiro[pyrrolidine-3,3'-quinoline]-1-carboxylate
CasNumber:
1160247-71-1
MolecularFormula:
C17H22N2O3
MolecularWeight:
302.36818000000005
MdlNumber:
MFCD12198632
Smiles:
O=C(N1CCC2(C1)Cc1ccccc1NC2=O)OC(C)(C)C
Complexity:
471
Covalently-bondedUnitCount:
1
HeavyAtomCount:
22
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
UndefinedAtomStereocenterCount:
1
Xlogp3:
1.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(N1CCC2(CC1)CNc1c2c(Br)ccc1)OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(N1CCC2(CC1)CNc1c2c(Br)ccc1)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: AI10110
ChemicalName: tert-Butyl 2',4'-dioxo-2',4'-dihydro-1'h-spiro[piperidine-4,3'-quinoline]-1-carboxylate
CasNumber: 1160247-78-8
MolecularFormula: C18H22N2O4
MolecularWeight: 330.3783
MdlNumber: MFCD12198640
Smiles: O=C(N1CCC2(CC1)C(=O)Nc1c(C2=O)cccc1)OC(C)(C)C
Complexity: 544
Covalently-bondedUnitCount: 1
HeavyAtomCount: 24
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 2
UndefinedAtomStereocenterCount: __
Xlogp3: 2
CatalogNumber:
AI10110
ChemicalName:
tert-Butyl 2',4'-dioxo-2',4'-dihydro-1'h-spiro[piperidine-4,3'-quinoline]-1-carboxylate
CasNumber:
1160247-78-8
MolecularFormula:
C18H22N2O4
MolecularWeight:
330.3783
MdlNumber:
MFCD12198640
Smiles:
O=C(N1CCC2(CC1)C(=O)Nc1c(C2=O)cccc1)OC(C)(C)C
Complexity:
544
Covalently-bondedUnitCount:
1
HeavyAtomCount:
24
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
2
UndefinedAtomStereocenterCount:
__
Xlogp3:
2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C1Nc2ccccc2CC21OCCNC2=O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C1Nc2ccccc2CC21OCCNC2=O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__