AD42604
1065074-55-6 | Methyl 6,8-dichloro-4-oxo-1,4-dihydroquinoline-2-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AD42604
ChemicalName
Methyl 6,8-dichloro-4-oxo-1,4-dihydroquinoline-2-carboxylate
CasNumber
1065074-55-6
MolecularFormula
C11H7Cl2NO3
MolecularWeight
272.0842
MdlNumber
MFCD11053815
Smiles
COC(=O)c1cc(=O)c2c([nH]1)c(Cl)cc(c2)Cl
Complexity
383
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
2.9
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CatalogNumber: AD42604
ChemicalName: Methyl 6,8-dichloro-4-oxo-1,4-dihydroquinoline-2-carboxylate
CasNumber: 1065074-55-6
MolecularFormula: C11H7Cl2NO3
MolecularWeight: 272.0842
MdlNumber: MFCD11053815
Smiles: COC(=O)c1cc(=O)c2c([nH]1)c(Cl)cc(c2)Cl
Complexity: 383
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2.9
CatalogNumber:
AD42604
ChemicalName:
Methyl 6,8-dichloro-4-oxo-1,4-dihydroquinoline-2-carboxylate
CasNumber:
1065074-55-6
MolecularFormula:
C11H7Cl2NO3
MolecularWeight:
272.0842
MdlNumber:
MFCD11053815
Smiles:
COC(=O)c1cc(=O)c2c([nH]1)c(Cl)cc(c2)Cl
Complexity:
383
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2.9
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Smiles: COC(=O)c1sc(nc1c1ccccc1Cl)N
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COC(=O)c1sc(nc1c1ccccc1Cl)N
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Smiles: Fc1ccccc1n1cn[nH]c1=O
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Fc1ccccc1n1cn[nH]c1=O
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Smiles: O=C/C=C/C=C/c1ccc(cc1)C
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Smiles:
O=C/C=C/C=C/c1ccc(cc1)C
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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