AA36271

1261912-75-7 | 5-(3-Aminocarbonylphenyl)picolinic acid

Manufacturer: A2B Chem

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CatalogNumber

AA36271

ChemicalName

5-(3-Aminocarbonylphenyl)picolinic acid

CasNumber

1261912-75-7

MolecularFormula

C13H10N2O3

MolecularWeight

242.2301

MdlNumber

MFCD18317312

Smiles

NC(=O)c1cccc(c1)c1ccc(nc1)C(=O)O

Complexity

332

Covalently-bondedUnitCount

1

HeavyAtomCount

18

HydrogenBondAcceptorCount

4

HydrogenBondDonorCount

2

RotatableBondCount

3

Xlogp3

1.2

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A2B Chem

AA36271

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CatalogNumber:
AA36271

ChemicalName:
5-(3-Aminocarbonylphenyl)picolinic acid

CasNumber:
1261912-75-7

MolecularFormula:
C13H10N2O3

MolecularWeight:
242.2301

MdlNumber:
MFCD18317312

Smiles:
NC(=O)c1cccc(c1)c1ccc(nc1)C(=O)O

Complexity:
332

Covalently-bondedUnitCount:
1

HeavyAtomCount:
18

HydrogenBondAcceptorCount:
4

HydrogenBondDonorCount:
2

RotatableBondCount:
3

Xlogp3:
1.2

Img

A2B Chem

AA36272

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CatalogNumber:
AA36272

ChemicalName:
3-(3-Benzyloxyphenyl)-5-nitrobenzoic acid

CasNumber:
1261912-55-3

MolecularFormula:
C20H15NO5

MolecularWeight:
349.3368

MdlNumber:
MFCD18322886

Smiles:
OC(=O)c1cc(cc(c1)[N+](=O)[O-])c1cccc(c1)OCc1ccccc1

Complexity:
485

Covalently-bondedUnitCount:
1

HeavyAtomCount:
26

HydrogenBondAcceptorCount:
5

HydrogenBondDonorCount:
1

RotatableBondCount:
5

Xlogp3:
4.4

Img

A2B Chem

AA36273

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CatalogNumber:
AA36273

ChemicalName:
4-(3-Benzyloxyphenyl)-3-fluorobenzoic acid

CasNumber:
1261912-21-3

MolecularFormula:
C20H15FO3

MolecularWeight:
322.3297

MdlNumber:
MFCD18322869

Smiles:
OC(=O)c1ccc(c(c1)F)c1cccc(c1)OCc1ccccc1

Complexity:
408

Covalently-bondedUnitCount:
1

HeavyAtomCount:
24

HydrogenBondAcceptorCount:
4

HydrogenBondDonorCount:
1

RotatableBondCount:
5

Xlogp3:
4.6

Img

A2B Chem

AA36274

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CatalogNumber:
AA36274

ChemicalName:
4-(3-Benzyloxyphenyl)-3-methylbenzoic acid

CasNumber:
1261911-97-0

MolecularFormula:
C21H18O3

MolecularWeight:
318.3658

MdlNumber:
MFCD18322860

Smiles:
OC(=O)c1ccc(c(c1)C)c1cccc(c1)OCc1ccccc1

Complexity:
402

Covalently-bondedUnitCount:
1

HeavyAtomCount:
24

HydrogenBondAcceptorCount:
3

HydrogenBondDonorCount:
1

RotatableBondCount:
5

Xlogp3:
4.9