AA53161
1215206-00-0 | 1-Benzyl-3-bromo-5-(trifluoromethyl)pyridin-2(1H)-one
Manufacturer: A2B Chem
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CatalogNumber
AA53161
ChemicalName
1-Benzyl-3-bromo-5-(trifluoromethyl)pyridin-2(1H)-one
CasNumber
1215206-00-0
MolecularFormula
C13H9BrF3NO
MolecularWeight
332.1159
MdlNumber
MFCD15143621
Smiles
Brc1cc(cn(c1=O)Cc1ccccc1)C(F)(F)F
Complexity
422
Covalently-bondedUnitCount
1
HeavyAtomCount
19
HydrogenBondAcceptorCount
4
RotatableBondCount
2
Xlogp3
3.2
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CatalogNumber: AA53161
ChemicalName: 1-Benzyl-3-bromo-5-(trifluoromethyl)pyridin-2(1H)-one
CasNumber: 1215206-00-0
MolecularFormula: C13H9BrF3NO
MolecularWeight: 332.1159
MdlNumber: MFCD15143621
Smiles: Brc1cc(cn(c1=O)Cc1ccccc1)C(F)(F)F
Complexity: 422
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 4
RotatableBondCount: 2
Xlogp3: 3.2
CatalogNumber:
AA53161
ChemicalName:
1-Benzyl-3-bromo-5-(trifluoromethyl)pyridin-2(1H)-one
CasNumber:
1215206-00-0
MolecularFormula:
C13H9BrF3NO
MolecularWeight:
332.1159
MdlNumber:
MFCD15143621
Smiles:
Brc1cc(cn(c1=O)Cc1ccccc1)C(F)(F)F
Complexity:
422
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
4
RotatableBondCount:
2
Xlogp3:
3.2
CatalogNumber: AA53162
ChemicalName: 1-Bromo-2-(methylsulfonyl)-4-(trifluoromethyl)benzene
CasNumber: 1215205-98-3
MolecularFormula: C8H6BrF3O2S
MolecularWeight: 303.0962
MdlNumber: MFCD03094286
Smiles: Brc1ccc(cc1S(=O)(=O)C)C(F)(F)F
Complexity: 320
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 5
RotatableBondCount: 1
Xlogp3: 2.7
CatalogNumber:
AA53162
ChemicalName:
1-Bromo-2-(methylsulfonyl)-4-(trifluoromethyl)benzene
CasNumber:
1215205-98-3
MolecularFormula:
C8H6BrF3O2S
MolecularWeight:
303.0962
MdlNumber:
MFCD03094286
Smiles:
Brc1ccc(cc1S(=O)(=O)C)C(F)(F)F
Complexity:
320
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
5
RotatableBondCount:
1
Xlogp3:
2.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Clc1ccc2c(n1)c(C)c(cc2)Cl
Complexity: 186
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 4.1
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Clc1ccc2c(n1)c(C)c(cc2)Cl
Complexity:
186
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
4.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Brc1cc(cc(c1)S(=O)(=O)C)C(F)(F)F
Complexity: 320
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 2.7
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Brc1cc(cc(c1)S(=O)(=O)C)C(F)(F)F
Complexity:
320
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
2.7