AD22446
482-45-1 | Isoimperatorin
Manufacturer: A2B Chem
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CatalogNumber
AD22446
ChemicalName
Isoimperatorin
CasNumber
482-45-1
MolecularFormula
C16H14O4
MolecularWeight
270.28
MdlNumber
MFCD00272155
Smiles
CC(=CCOc1c2ccoc2cc2c1ccc(=O)o2)C
Complexity
436
Covalently-bondedUnitCount
1
HeavyAtomCount
20
HydrogenBondAcceptorCount
4
RotatableBondCount
3
Xlogp3
3.8
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CatalogNumber: AD22446
ChemicalName: Isoimperatorin
CasNumber: 482-45-1
MolecularFormula: C16H14O4
MolecularWeight: 270.28
MdlNumber: MFCD00272155
Smiles: CC(=CCOc1c2ccoc2cc2c1ccc(=O)o2)C
Complexity: 436
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 4
RotatableBondCount: 3
Xlogp3: 3.8
CatalogNumber:
AD22446
ChemicalName:
Isoimperatorin
CasNumber:
482-45-1
MolecularFormula:
C16H14O4
MolecularWeight:
270.28
MdlNumber:
MFCD00272155
Smiles:
CC(=CCOc1c2ccoc2cc2c1ccc(=O)o2)C
Complexity:
436
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
4
RotatableBondCount:
3
Xlogp3:
3.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CN1CC=C(C=C1)C1=C2C=CC(=N2)C=c2ccc(=CC3=NC(=Cc4n(c1c(C1=CCN(C=C1)C)c4C1=CCN(C=C1)C)C1=CCN(C=C1)C)C=C3)[nH]2.[Cu]
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
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Smiles:
CN1CC=C(C=C1)C1=C2C=CC(=N2)C=c2ccc(=CC3=NC(=Cc4n(c1c(C1=CCN(C=C1)C)c4C1=CCN(C=C1)C)C1=CCN(C=C1)C)C=C3)[nH]2.[Cu]
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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ChemicalName: __
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MolecularFormula: __
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Smiles: Nc1ccc(c(c1)C)N1CCOCC1=O
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Smiles:
Nc1ccc(c(c1)C)N1CCOCC1=O
Complexity:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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Smiles: SCC(=O)Nc1ccccc1
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
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Smiles:
SCC(=O)Nc1ccccc1
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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