AI10059
1160246-78-5 | Benzyl 2-oxo-1,8-diazaspiro[4.6]undecane-8-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AI10059
ChemicalName
Benzyl 2-oxo-1,8-diazaspiro[4.6]undecane-8-carboxylate
CasNumber
1160246-78-5
MolecularFormula
C17H22N2O3
MolecularWeight
302.3682
MdlNumber
MFCD12198512
Smiles
O=C1CCC2(N1)CCCN(CC2)C(=O)OCc1ccccc1
Complexity
420
Covalently-bondedUnitCount
1
HeavyAtomCount
22
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
3
UndefinedAtomStereocenterCount
1
Xlogp3
1.7
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CatalogNumber: AI10059
ChemicalName: Benzyl 2-oxo-1,8-diazaspiro[4.6]undecane-8-carboxylate
CasNumber: 1160246-78-5
MolecularFormula: C17H22N2O3
MolecularWeight: 302.3682
MdlNumber: MFCD12198512
Smiles: O=C1CCC2(N1)CCCN(CC2)C(=O)OCc1ccccc1
Complexity: 420
Covalently-bondedUnitCount: 1
HeavyAtomCount: 22
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
UndefinedAtomStereocenterCount: 1
Xlogp3: 1.7
CatalogNumber:
AI10059
ChemicalName:
Benzyl 2-oxo-1,8-diazaspiro[4.6]undecane-8-carboxylate
CasNumber:
1160246-78-5
MolecularFormula:
C17H22N2O3
MolecularWeight:
302.3682
MdlNumber:
MFCD12198512
Smiles:
O=C1CCC2(N1)CCCN(CC2)C(=O)OCc1ccccc1
Complexity:
420
Covalently-bondedUnitCount:
1
HeavyAtomCount:
22
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
UndefinedAtomStereocenterCount:
1
Xlogp3:
1.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)C1C(=O)NCC21CCN(CC2)C(=O)OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)C1C(=O)NCC21CCN(CC2)C(=O)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)C1OCC2(C1)CCCN(C2)C(=O)OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)C1OCC2(C1)CCCN(C2)C(=O)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: AI10062
ChemicalName: tert-Butyl 3-cyano-1-oxa-8-azaspiro[4.5]decane-8-carboxylate
CasNumber: 1160246-93-4
MolecularFormula: C14H22N2O3
MolecularWeight: 266.3361
MdlNumber: MFCD12198531
Smiles: N#CC1COC2(C1)CCN(CC2)C(=O)OC(C)(C)C
Complexity: 397
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: __
RotatableBondCount: 2
UndefinedAtomStereocenterCount: 1
Xlogp3: 1.2
CatalogNumber:
AI10062
ChemicalName:
tert-Butyl 3-cyano-1-oxa-8-azaspiro[4.5]decane-8-carboxylate
CasNumber:
1160246-93-4
MolecularFormula:
C14H22N2O3
MolecularWeight:
266.3361
MdlNumber:
MFCD12198531
Smiles:
N#CC1COC2(C1)CCN(CC2)C(=O)OC(C)(C)C
Complexity:
397
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
__
RotatableBondCount:
2
UndefinedAtomStereocenterCount:
1
Xlogp3:
1.2