AG10080
36640-52-5 | 1-Phenyl-3-p-tolyl-1h-pyrazole-4-carbaldehyde
Manufacturer: A2B Chem
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CatalogNumber
AG10080
ChemicalName
1-Phenyl-3-p-tolyl-1h-pyrazole-4-carbaldehyde
CasNumber
36640-52-5
MolecularFormula
C17H14N2O
MolecularWeight
262.3059
MdlNumber
MFCD00744772
Smiles
O=Cc1cn(nc1c1ccc(cc1)C)c1ccccc1
Complexity
319
Covalently-bondedUnitCount
1
HeavyAtomCount
20
HydrogenBondAcceptorCount
2
RotatableBondCount
3
Xlogp3
3.4
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CatalogNumber: AG10080
ChemicalName: 1-Phenyl-3-p-tolyl-1h-pyrazole-4-carbaldehyde
CasNumber: 36640-52-5
MolecularFormula: C17H14N2O
MolecularWeight: 262.3059
MdlNumber: MFCD00744772
Smiles: O=Cc1cn(nc1c1ccc(cc1)C)c1ccccc1
Complexity: 319
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 2
RotatableBondCount: 3
Xlogp3: 3.4
CatalogNumber:
AG10080
ChemicalName:
1-Phenyl-3-p-tolyl-1h-pyrazole-4-carbaldehyde
CasNumber:
36640-52-5
MolecularFormula:
C17H14N2O
MolecularWeight:
262.3059
MdlNumber:
MFCD00744772
Smiles:
O=Cc1cn(nc1c1ccc(cc1)C)c1ccccc1
Complexity:
319
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
2
RotatableBondCount:
3
Xlogp3:
3.4
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Smiles: CCc1nnc(o1)O
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Smiles:
CCc1nnc(o1)O
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Smiles: S=c1[nH]c2sc3c(c2c(=S)[nH]1)CCCC3
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S=c1[nH]c2sc3c(c2c(=S)[nH]1)CCCC3
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Smiles: CC(CC(CC1(C)OC(=O)C23C1CCC3(C)C1=CCC3C(C1CC2)(C)CC(OC1OCC(C(C1OC1OC(C)C(C(C1O)O)O)O)O)CC3(C)C)OC(=O)C)C
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Smiles:
CC(CC(CC1(C)OC(=O)C23C1CCC3(C)C1=CCC3C(C1CC2)(C)CC(OC1OCC(C(C1OC1OC(C)C(C(C1O)O)O)O)O)CC3(C)C)OC(=O)C)C
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
__
RotatableBondCount:
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Xlogp3:
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