AA36267
1261913-25-0 | 6-Amino-3-(4-t-butylphenyl)picolinic acid
Manufacturer: A2B Chem
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CatalogNumber
AA36267
ChemicalName
6-Amino-3-(4-t-butylphenyl)picolinic acid
CasNumber
1261913-25-0
MolecularFormula
C16H18N2O2
MolecularWeight
270.3263
MdlNumber
MFCD18323587
Smiles
Nc1ccc(c(n1)C(=O)O)c1ccc(cc1)C(C)(C)C
Complexity
343
Covalently-bondedUnitCount
1
HeavyAtomCount
20
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
3
Xlogp3
3.7
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CatalogNumber: AA36267
ChemicalName: 6-Amino-3-(4-t-butylphenyl)picolinic acid
CasNumber: 1261913-25-0
MolecularFormula: C16H18N2O2
MolecularWeight: 270.3263
MdlNumber: MFCD18323587
Smiles: Nc1ccc(c(n1)C(=O)O)c1ccc(cc1)C(C)(C)C
Complexity: 343
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 3
Xlogp3: 3.7
CatalogNumber:
AA36267
ChemicalName:
6-Amino-3-(4-t-butylphenyl)picolinic acid
CasNumber:
1261913-25-0
MolecularFormula:
C16H18N2O2
MolecularWeight:
270.3263
MdlNumber:
MFCD18323587
Smiles:
Nc1ccc(c(n1)C(=O)O)c1ccc(cc1)C(C)(C)C
Complexity:
343
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
3
Xlogp3:
3.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)c1ccc(cc1Cl)c1cccc(c1)S(=O)(=O)C
Complexity: 456
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 2.9
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)c1ccc(cc1Cl)c1cccc(c1)S(=O)(=O)C
Complexity:
456
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
2.9
CatalogNumber: AA36270
ChemicalName: 4-(4-Benzyloxyphenyl)-3-fluorobenzoic acid
CasNumber: 1261913-01-2
MolecularFormula: C20H15FO3
MolecularWeight: 322.3297
MdlNumber: MFCD18322900
Smiles: OC(=O)c1ccc(c(c1)F)c1ccc(cc1)OCc1ccccc1
Complexity: 400
Covalently-bondedUnitCount: 1
HeavyAtomCount: 24
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 5
Xlogp3: 4.6
CatalogNumber:
AA36270
ChemicalName:
4-(4-Benzyloxyphenyl)-3-fluorobenzoic acid
CasNumber:
1261913-01-2
MolecularFormula:
C20H15FO3
MolecularWeight:
322.3297
MdlNumber:
MFCD18322900
Smiles:
OC(=O)c1ccc(c(c1)F)c1ccc(cc1)OCc1ccccc1
Complexity:
400
Covalently-bondedUnitCount:
1
HeavyAtomCount:
24
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
5
Xlogp3:
4.6
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
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