AG20723
52980-28-6 | Ethyl 4-oxo-1,4-dihydro-3-quinolinecarboxylate
Manufacturer: A2B Chem
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CatalogNumber
AG20723
ChemicalName
Ethyl 4-oxo-1,4-dihydro-3-quinolinecarboxylate
CasNumber
52980-28-6
MolecularFormula
C12H11NO3
MolecularWeight
217.2206
MdlNumber
MFCD01314279
Smiles
CCOC(=O)c1cnc2c(c1O)cccc2
NscNumber
4345
Complexity
335
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
2
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CatalogNumber: AG20723
ChemicalName: Ethyl 4-oxo-1,4-dihydro-3-quinolinecarboxylate
CasNumber: 52980-28-6
MolecularFormula: C12H11NO3
MolecularWeight: 217.2206
MdlNumber: MFCD01314279
Smiles: CCOC(=O)c1cnc2c(c1O)cccc2
NscNumber: 4345
Complexity: 335
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 2
CatalogNumber:
AG20723
ChemicalName:
Ethyl 4-oxo-1,4-dihydro-3-quinolinecarboxylate
CasNumber:
52980-28-6
MolecularFormula:
C12H11NO3
MolecularWeight:
217.2206
MdlNumber:
MFCD01314279
Smiles:
CCOC(=O)c1cnc2c(c1O)cccc2
NscNumber:
4345
Complexity:
335
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
2
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Smiles: CCCCN(CCCC)CCCOc1ccc(cc1)C(=O)O.Cl
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Smiles:
CCCCN(CCCC)CCCOc1ccc(cc1)C(=O)O.Cl
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Smiles: COc1cccc(c1)c1nc2ccccc2c(=O)[nH]1
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Smiles:
COc1cccc(c1)c1nc2ccccc2c(=O)[nH]1
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HeavyAtomCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: O=C1CCC(CC1)(c1cc(F)ccc1F)S(=O)(=O)c1ccc(cc1)Cl
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
O=C1CCC(CC1)(c1cc(F)ccc1F)S(=O)(=O)c1ccc(cc1)Cl
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__