AC79206
67571-90-8 | 3-Benzyl-3,8-diazabicyclo[3.2.1]octane
Manufacturer: A2B Chem
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CatalogNumber
AC79206
ChemicalName
3-Benzyl-3,8-diazabicyclo[3.2.1]octane
CasNumber
67571-90-8
MolecularFormula
C13H18N2
MolecularWeight
202.2954
MdlNumber
MFCD20441694
Smiles
C1CC2NC1CN(C2)Cc1ccccc1
Complexity
199
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
2
UndefinedAtomStereocenterCount
2
Xlogp3
1.7
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CatalogNumber: AC79206
ChemicalName: 3-Benzyl-3,8-diazabicyclo[3.2.1]octane
CasNumber: 67571-90-8
MolecularFormula: C13H18N2
MolecularWeight: 202.2954
MdlNumber: MFCD20441694
Smiles: C1CC2NC1CN(C2)Cc1ccccc1
Complexity: 199
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 2
UndefinedAtomStereocenterCount: 2
Xlogp3: 1.7
CatalogNumber:
AC79206
ChemicalName:
3-Benzyl-3,8-diazabicyclo[3.2.1]octane
CasNumber:
67571-90-8
MolecularFormula:
C13H18N2
MolecularWeight:
202.2954
MdlNumber:
MFCD20441694
Smiles:
C1CC2NC1CN(C2)Cc1ccccc1
Complexity:
199
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
2
UndefinedAtomStereocenterCount:
2
Xlogp3:
1.7
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Smiles: CCOC(=O)C(=O)Nc1nc2c(s1)cccc2
Complexity: __
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Smiles:
CCOC(=O)C(=O)Nc1nc2c(s1)cccc2
Complexity:
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HeavyAtomCount:
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Smiles: OC(=O)CSCC(F)(F)F
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Smiles:
OC(=O)CSCC(F)(F)F
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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UndefinedAtomStereocenterCount:
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Smiles: CCCCCB1OC(C(O1)(C)C)(C)C
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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RotatableBondCount: __
UndefinedAtomStereocenterCount: __
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ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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Smiles:
CCCCCB1OC(C(O1)(C)C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__