AD54103
1355247-57-2 | N,N-Dimethyl-4-(4-nitrophenyl)benzamide
Manufacturer: A2B Chem
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CatalogNumber
AD54103
ChemicalName
N,N-Dimethyl-4-(4-nitrophenyl)benzamide
CasNumber
1355247-57-2
MolecularFormula
C15H14N2O3
MolecularWeight
270.2833
MdlNumber
MFCD21332995
Smiles
CN(C(=O)c1ccc(cc1)c1ccc(cc1)[N+](=O)[O-])C
Complexity
349
Covalently-bondedUnitCount
1
HeavyAtomCount
20
HydrogenBondAcceptorCount
3
RotatableBondCount
2
Xlogp3
2.8
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CatalogNumber: AD54103
ChemicalName: N,N-Dimethyl-4-(4-nitrophenyl)benzamide
CasNumber: 1355247-57-2
MolecularFormula: C15H14N2O3
MolecularWeight: 270.2833
MdlNumber: MFCD21332995
Smiles: CN(C(=O)c1ccc(cc1)c1ccc(cc1)[N+](=O)[O-])C
Complexity: 349
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 3
RotatableBondCount: 2
Xlogp3: 2.8
CatalogNumber:
AD54103
ChemicalName:
N,N-Dimethyl-4-(4-nitrophenyl)benzamide
CasNumber:
1355247-57-2
MolecularFormula:
C15H14N2O3
MolecularWeight:
270.2833
MdlNumber:
MFCD21332995
Smiles:
CN(C(=O)c1ccc(cc1)c1ccc(cc1)[N+](=O)[O-])C
Complexity:
349
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
3
RotatableBondCount:
2
Xlogp3:
2.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: [O-][N+](=O)c1cccc(c1)c1ccc(c(c1)F)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
[O-][N+](=O)c1cccc(c1)c1ccc(c(c1)F)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AD54105
ChemicalName: Methyl 3-(3-chloro-4-cyanophenyl)benzoate
CasNumber: 1355247-44-7
MolecularFormula: C15H10ClNO2
MolecularWeight: 271.6984
MdlNumber: MFCD21333007
Smiles: COC(=O)c1cccc(c1)c1ccc(c(c1)Cl)C#N
Complexity: 376
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 3
RotatableBondCount: 3
Xlogp3: 3.7
CatalogNumber:
AD54105
ChemicalName:
Methyl 3-(3-chloro-4-cyanophenyl)benzoate
CasNumber:
1355247-44-7
MolecularFormula:
C15H10ClNO2
MolecularWeight:
271.6984
MdlNumber:
MFCD21333007
Smiles:
COC(=O)c1cccc(c1)c1ccc(c(c1)Cl)C#N
Complexity:
376
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
3
RotatableBondCount:
3
Xlogp3:
3.7
CatalogNumber: AD54106
ChemicalName: 2-(2-Carboxyphenyl)-5-fluorobenzoic acid
CasNumber: 1355247-36-7
MolecularFormula: C14H9FO4
MolecularWeight: 260.2173
MdlNumber: MFCD21332946
Smiles: Fc1ccc(c(c1)C(=O)O)c1ccccc1C(=O)O
Complexity: 357
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 5
RotatableBondCount: 3
Xlogp3: 2.2
CatalogNumber:
AD54106
ChemicalName:
2-(2-Carboxyphenyl)-5-fluorobenzoic acid
CasNumber:
1355247-36-7
MolecularFormula:
C14H9FO4
MolecularWeight:
260.2173
MdlNumber:
MFCD21332946
Smiles:
Fc1ccc(c(c1)C(=O)O)c1ccccc1C(=O)O
Complexity:
357
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
5
RotatableBondCount:
3
Xlogp3:
2.2