AA33626
120014-07-5 | 1-Benzyl-4-(5,6-dimethoxy-1-oxoindan-2-ylindenemethyl)piperidine
Manufacturer: A2B Chem
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CatalogNumber
AA33626
ChemicalName
1-Benzyl-4-(5,6-dimethoxy-1-oxoindan-2-ylindenemethyl)piperidine
CasNumber
120014-07-5
MolecularFormula
C24H27NO3
MolecularWeight
377.4761
MdlNumber
MFCD08693144
Smiles
COc1cc2c(cc1OC)C/C(=C\C1CCN(CC1)Cc1ccccc1)/C2=O
Complexity
560
Covalently-bondedUnitCount
1
DefinedBondStereocenterCount
1
HeavyAtomCount
28
HydrogenBondAcceptorCount
4
RotatableBondCount
5
Xlogp3
4.2
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CatalogNumber: AA33626
ChemicalName: 1-Benzyl-4-(5,6-dimethoxy-1-oxoindan-2-ylindenemethyl)piperidine
CasNumber: 120014-07-5
MolecularFormula: C24H27NO3
MolecularWeight: 377.4761
MdlNumber: MFCD08693144
Smiles: COc1cc2c(cc1OC)C/C(=C\C1CCN(CC1)Cc1ccccc1)/C2=O
Complexity: 560
Covalently-bondedUnitCount: 1
DefinedBondStereocenterCount: 1
HeavyAtomCount: 28
HydrogenBondAcceptorCount: 4
RotatableBondCount: 5
Xlogp3: 4.2
CatalogNumber:
AA33626
ChemicalName:
1-Benzyl-4-(5,6-dimethoxy-1-oxoindan-2-ylindenemethyl)piperidine
CasNumber:
120014-07-5
MolecularFormula:
C24H27NO3
MolecularWeight:
377.4761
MdlNumber:
MFCD08693144
Smiles:
COc1cc2c(cc1OC)C/C(=C\C1CCN(CC1)Cc1ccccc1)/C2=O
Complexity:
560
Covalently-bondedUnitCount:
1
DefinedBondStereocenterCount:
1
HeavyAtomCount:
28
HydrogenBondAcceptorCount:
4
RotatableBondCount:
5
Xlogp3:
4.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1cc2c(cc1OC)CC(C2=O)CC1CCN(CC1)Cc1ccccc1
Complexity: 510
Covalently-bondedUnitCount: __
DefinedBondStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 4.3
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MolecularFormula:
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MolecularWeight:
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Smiles:
COc1cc2c(cc1OC)CC(C2=O)CC1CCN(CC1)Cc1ccccc1
Complexity:
510
Covalently-bondedUnitCount:
__
DefinedBondStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
4.3
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Smiles: COCC(OCC(O)C)C
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Smiles:
COCC(OCC(O)C)C
Complexity:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: Clc1c(Cl)cccc1Cl
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__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MdlNumber:
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Smiles:
Clc1c(Cl)cccc1Cl
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedBondStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__