AB26871
249737-01-7 | 3-Amino-6,7-dimethoxy-4-(trifluoromethyl)quinolin-2-ol
Manufacturer: A2B Chem
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CatalogNumber
AB26871
ChemicalName
3-Amino-6,7-dimethoxy-4-(trifluoromethyl)quinolin-2-ol
CasNumber
249737-01-7
MolecularFormula
C12H11F3N2O3
MolecularWeight
288.2225
MdlNumber
MFCD06654745
Smiles
COc1cc2[nH]c(=O)c(c(c2cc1OC)C(F)(F)F)N
Complexity
436
Covalently-bondedUnitCount
1
HeavyAtomCount
20
HydrogenBondAcceptorCount
7
HydrogenBondDonorCount
2
RotatableBondCount
2
Xlogp3
1.2
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CatalogNumber: AB26871
ChemicalName: 3-Amino-6,7-dimethoxy-4-(trifluoromethyl)quinolin-2-ol
CasNumber: 249737-01-7
MolecularFormula: C12H11F3N2O3
MolecularWeight: 288.2225
MdlNumber: MFCD06654745
Smiles: COc1cc2[nH]c(=O)c(c(c2cc1OC)C(F)(F)F)N
Complexity: 436
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 7
HydrogenBondDonorCount: 2
RotatableBondCount: 2
Xlogp3: 1.2
CatalogNumber:
AB26871
ChemicalName:
3-Amino-6,7-dimethoxy-4-(trifluoromethyl)quinolin-2-ol
CasNumber:
249737-01-7
MolecularFormula:
C12H11F3N2O3
MolecularWeight:
288.2225
MdlNumber:
MFCD06654745
Smiles:
COc1cc2[nH]c(=O)c(c(c2cc1OC)C(F)(F)F)N
Complexity:
436
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
7
HydrogenBondDonorCount:
2
RotatableBondCount:
2
Xlogp3:
1.2
CatalogNumber: AB26872
ChemicalName: 6,7-Dimethoxy-4-(trifluoromethyl)quinolin-2(1h)-one
CasNumber: 249736-95-6
MolecularFormula: C12H10F3NO3
MolecularWeight: 273.2079
MdlNumber: MFCD06654703
Smiles: COc1cc2[nH]c(=O)cc(c2cc1OC)C(F)(F)F
Complexity: 394
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 1.7
CatalogNumber:
AB26872
ChemicalName:
6,7-Dimethoxy-4-(trifluoromethyl)quinolin-2(1h)-one
CasNumber:
249736-95-6
MolecularFormula:
C12H10F3NO3
MolecularWeight:
273.2079
MdlNumber:
MFCD06654703
Smiles:
COc1cc2[nH]c(=O)cc(c2cc1OC)C(F)(F)F
Complexity:
394
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
1.7
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Smiles: [O-][N+](=O)c1ccccc1CS(=O)(=O)Cl
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[O-][N+](=O)c1ccccc1CS(=O)(=O)Cl
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Smiles: Brc1ccccc1CS(=O)(=O)Cl
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Smiles:
Brc1ccccc1CS(=O)(=O)Cl
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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