AI48752
355397-64-7 | 2,3-Bis(4-fluorophenyl)quinoxaline-6-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AI48752
ChemicalName
2,3-Bis(4-fluorophenyl)quinoxaline-6-carboxylic acid
CasNumber
355397-64-7
MolecularFormula
C21H12F2N2O2
MolecularWeight
362.329
MdlNumber
MFCD02041145
Smiles
Fc1ccc(cc1)c1nc2cc(ccc2nc1c1ccc(cc1)F)C(=O)O
Complexity
518
Covalently-bondedUnitCount
1
HeavyAtomCount
27
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
4.3
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CatalogNumber: AI48752
ChemicalName: 2,3-Bis(4-fluorophenyl)quinoxaline-6-carboxylic acid
CasNumber: 355397-64-7
MolecularFormula: C21H12F2N2O2
MolecularWeight: 362.329
MdlNumber: MFCD02041145
Smiles: Fc1ccc(cc1)c1nc2cc(ccc2nc1c1ccc(cc1)F)C(=O)O
Complexity: 518
Covalently-bondedUnitCount: 1
HeavyAtomCount: 27
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 4.3
CatalogNumber:
AI48752
ChemicalName:
2,3-Bis(4-fluorophenyl)quinoxaline-6-carboxylic acid
CasNumber:
355397-64-7
MolecularFormula:
C21H12F2N2O2
MolecularWeight:
362.329
MdlNumber:
MFCD02041145
Smiles:
Fc1ccc(cc1)c1nc2cc(ccc2nc1c1ccc(cc1)F)C(=O)O
Complexity:
518
Covalently-bondedUnitCount:
1
HeavyAtomCount:
27
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
4.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C=CCOC(c1ccc(cc1Cl)Cl)Cn1cncc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
C=CCOC(c1ccc(cc1Cl)Cl)Cn1cncc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AI48754
ChemicalName: 1-(3-Methoxy-4-methylphenyl)ethan-1-one
CasNumber: 3556-81-8
MolecularFormula: C10H12O2
MolecularWeight: 164.20108000000002
MdlNumber: MFCD22573028
Smiles: COc1cc(ccc1C)C(=O)C
Complexity: 165
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: __
RotatableBondCount: 2
Xlogp3: 2.5
CatalogNumber:
AI48754
ChemicalName:
1-(3-Methoxy-4-methylphenyl)ethan-1-one
CasNumber:
3556-81-8
MolecularFormula:
C10H12O2
MolecularWeight:
164.20108000000002
MdlNumber:
MFCD22573028
Smiles:
COc1cc(ccc1C)C(=O)C
Complexity:
165
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
__
RotatableBondCount:
2
Xlogp3:
2.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COP(=O)(SCn1c(=O)oc2c1ncc(c2)Cl)OC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COP(=O)(SCn1c(=O)oc2c1ncc(c2)Cl)OC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__