AB30024
262586-62-9 | Methyl 6-bromo-4-oxo-1,4-dihydroquinoline-2-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AB30024
ChemicalName
Methyl 6-bromo-4-oxo-1,4-dihydroquinoline-2-carboxylate
CasNumber
262586-62-9
MolecularFormula
C11H8BrNO3
MolecularWeight
282.09012
MdlNumber
MFCD10001494
Smiles
COC(=O)c1cc(=O)c2c([nH]1)ccc(c2)Br
Complexity
353
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
2.3
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CatalogNumber: AB30024
ChemicalName: Methyl 6-bromo-4-oxo-1,4-dihydroquinoline-2-carboxylate
CasNumber: 262586-62-9
MolecularFormula: C11H8BrNO3
MolecularWeight: 282.09012
MdlNumber: MFCD10001494
Smiles: COC(=O)c1cc(=O)c2c([nH]1)ccc(c2)Br
Complexity: 353
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2.3
CatalogNumber:
AB30024
ChemicalName:
Methyl 6-bromo-4-oxo-1,4-dihydroquinoline-2-carboxylate
CasNumber:
262586-62-9
MolecularFormula:
C11H8BrNO3
MolecularWeight:
282.09012
MdlNumber:
MFCD10001494
Smiles:
COC(=O)c1cc(=O)c2c([nH]1)ccc(c2)Br
Complexity:
353
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2.3
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Smiles: C=C1CC/C=C(C)/CCCC(/C=C/1)(C)C
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C=C1CC/C=C(C)/CCCC(/C=C/1)(C)C
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Smiles: CCNc1nc(NC(CC)C)nc(n1)OC
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CCNc1nc(NC(CC)C)nc(n1)OC
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Smiles: S=C=NCCCN(CC)CC
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Smiles:
S=C=NCCCN(CC)CC
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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