AA49078
1365272-82-7 | 2-Fluoro-4-(3-fluoro-5-methoxyphenyl)benzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AA49078
ChemicalName
2-Fluoro-4-(3-fluoro-5-methoxyphenyl)benzoic acid
CasNumber
1365272-82-7
MolecularFormula
C14H10F2O3
MolecularWeight
264.2242
MdlNumber
MFCD21609598
Smiles
COc1cc(F)cc(c1)c1ccc(c(c1)F)C(=O)O
Complexity
324
Covalently-bondedUnitCount
1
HeavyAtomCount
19
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
3.2
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CatalogNumber: AA49078
ChemicalName: 2-Fluoro-4-(3-fluoro-5-methoxyphenyl)benzoic acid
CasNumber: 1365272-82-7
MolecularFormula: C14H10F2O3
MolecularWeight: 264.2242
MdlNumber: MFCD21609598
Smiles: COc1cc(F)cc(c1)c1ccc(c(c1)F)C(=O)O
Complexity: 324
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 3.2
CatalogNumber:
AA49078
ChemicalName:
2-Fluoro-4-(3-fluoro-5-methoxyphenyl)benzoic acid
CasNumber:
1365272-82-7
MolecularFormula:
C14H10F2O3
MolecularWeight:
264.2242
MdlNumber:
MFCD21609598
Smiles:
COc1cc(F)cc(c1)c1ccc(c(c1)F)C(=O)O
Complexity:
324
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
3.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Fc1cc2n(nnc2cc1Br)C1CCCCC1
Complexity: 273
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 3.9
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Fc1cc2n(nnc2cc1Br)C1CCCCC1
Complexity:
273
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
3.9
CatalogNumber: AA49080
ChemicalName: N-[(4-Bromophenyl)(3-fluorophenyl)methyl]acetamide
CasNumber: 1365272-80-5
MolecularFormula: C15H13BrFNO
MolecularWeight: 322.1722
MdlNumber: MFCD21609712
Smiles: CC(=O)NC(c1cccc(c1)F)c1ccc(cc1)Br
Complexity: 305
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 3.5
CatalogNumber:
AA49080
ChemicalName:
N-[(4-Bromophenyl)(3-fluorophenyl)methyl]acetamide
CasNumber:
1365272-80-5
MolecularFormula:
C15H13BrFNO
MolecularWeight:
322.1722
MdlNumber:
MFCD21609712
Smiles:
CC(=O)NC(c1cccc(c1)F)c1ccc(cc1)Br
Complexity:
305
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
3.5
CatalogNumber: AA49081
ChemicalName: 4-Bromo-2-(cyclopentylamino)benzonitrile
CasNumber: 1365272-79-2
MolecularFormula: C12H13BrN2
MolecularWeight: 265.149
MdlNumber: MFCD21609721
Smiles: N#Cc1ccc(cc1NC1CCCC1)Br
Complexity: 252
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 4.1
CatalogNumber:
AA49081
ChemicalName:
4-Bromo-2-(cyclopentylamino)benzonitrile
CasNumber:
1365272-79-2
MolecularFormula:
C12H13BrN2
MolecularWeight:
265.149
MdlNumber:
MFCD21609721
Smiles:
N#Cc1ccc(cc1NC1CCCC1)Br
Complexity:
252
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
4.1