AA28473
1245-13-2 | 2,2'-Biquinoline-4,4'-dicarboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AA28473
ChemicalName
2,2'-Biquinoline-4,4'-dicarboxylic acid
CasNumber
1245-13-2
MolecularFormula
C20H12N2O4
MolecularWeight
344.3203
MdlNumber
MFCD00068342
Smiles
OC(=O)c1cc(nc2c1cccc2)c1nc2ccccc2c(c1)C(=O)O
NscNumber
133815
Complexity
506
Covalently-bondedUnitCount
1
HeavyAtomCount
26
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
2
RotatableBondCount
3
Xlogp3
3.2
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CatalogNumber: AA28473
ChemicalName: 2,2'-Biquinoline-4,4'-dicarboxylic acid
CasNumber: 1245-13-2
MolecularFormula: C20H12N2O4
MolecularWeight: 344.3203
MdlNumber: MFCD00068342
Smiles: OC(=O)c1cc(nc2c1cccc2)c1nc2ccccc2c(c1)C(=O)O
NscNumber: 133815
Complexity: 506
Covalently-bondedUnitCount: 1
HeavyAtomCount: 26
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 2
RotatableBondCount: 3
Xlogp3: 3.2
CatalogNumber:
AA28473
ChemicalName:
2,2'-Biquinoline-4,4'-dicarboxylic acid
CasNumber:
1245-13-2
MolecularFormula:
C20H12N2O4
MolecularWeight:
344.3203
MdlNumber:
MFCD00068342
Smiles:
OC(=O)c1cc(nc2c1cccc2)c1nc2ccccc2c(c1)C(=O)O
NscNumber:
133815
Complexity:
506
Covalently-bondedUnitCount:
1
HeavyAtomCount:
26
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
2
RotatableBondCount:
3
Xlogp3:
3.2
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Smiles: O=C1CSc2c(N1)c(Cl)cc(c2)F
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O=C1CSc2c(N1)c(Cl)cc(c2)F
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Smiles: Cc1ccccc1n1nc(cc1Br)c1ccccc1
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Cc1ccccc1n1nc(cc1Br)c1ccccc1
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Smiles: CCOC(=O)c1cnn(c1Br)c1ccccc1F
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Complexity: __
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ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
CCOC(=O)c1cnn(c1Br)c1ccccc1F
NscNumber:
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Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
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