AA49072
1365272-25-8 | 4-(2-Cyanophenyl)-N-ethyl-2-fluorobenzamide
Manufacturer: A2B Chem
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CatalogNumber
AA49072
ChemicalName
4-(2-Cyanophenyl)-N-ethyl-2-fluorobenzamide
CasNumber
1365272-25-8
MolecularFormula
C16H13FN2O
MolecularWeight
268.2856
MdlNumber
MFCD21609643
Smiles
CCNC(=O)c1ccc(cc1F)c1ccccc1C#N
Complexity
389
Covalently-bondedUnitCount
1
HeavyAtomCount
20
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
3
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CatalogNumber: AA49072
ChemicalName: 4-(2-Cyanophenyl)-N-ethyl-2-fluorobenzamide
CasNumber: 1365272-25-8
MolecularFormula: C16H13FN2O
MolecularWeight: 268.2856
MdlNumber: MFCD21609643
Smiles: CCNC(=O)c1ccc(cc1F)c1ccccc1C#N
Complexity: 389
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 3
CatalogNumber:
AA49072
ChemicalName:
4-(2-Cyanophenyl)-N-ethyl-2-fluorobenzamide
CasNumber:
1365272-25-8
MolecularFormula:
C16H13FN2O
MolecularWeight:
268.2856
MdlNumber:
MFCD21609643
Smiles:
CCNC(=O)c1ccc(cc1F)c1ccccc1C#N
Complexity:
389
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
3
CatalogNumber: AA49073
ChemicalName: 4-(2-Cyanophenyl)-N,N-dimethylbenzamide
CasNumber: 1365272-24-7
MolecularFormula: C16H14N2O
MolecularWeight: 250.2952
MdlNumber: MFCD21609617
Smiles: N#Cc1ccccc1c1ccc(cc1)C(=O)N(C)C
Complexity: 360
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: __
RotatableBondCount: 2
Xlogp3: 2.7
CatalogNumber:
AA49073
ChemicalName:
4-(2-Cyanophenyl)-N,N-dimethylbenzamide
CasNumber:
1365272-24-7
MolecularFormula:
C16H14N2O
MolecularWeight:
250.2952
MdlNumber:
MFCD21609617
Smiles:
N#Cc1ccccc1c1ccc(cc1)C(=O)N(C)C
Complexity:
360
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
__
RotatableBondCount:
2
Xlogp3:
2.7
CatalogNumber: AA49074
ChemicalName: N-[1-(4-bromophenyl)cyclopropyl]methanesulfonamide
CasNumber: 1365272-86-1
MolecularFormula: C10H12BrNO2S
MolecularWeight: 290.1768
MdlNumber: MFCD21609650
Smiles: Brc1ccc(cc1)C1(CC1)NS(=O)(=O)C
Complexity: 324
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 1.9
CatalogNumber:
AA49074
ChemicalName:
N-[1-(4-bromophenyl)cyclopropyl]methanesulfonamide
CasNumber:
1365272-86-1
MolecularFormula:
C10H12BrNO2S
MolecularWeight:
290.1768
MdlNumber:
MFCD21609650
Smiles:
Brc1ccc(cc1)C1(CC1)NS(=O)(=O)C
Complexity:
324
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
1.9
CatalogNumber: AA49075
ChemicalName: 4-Bromo-N-isopropyl-2-nitro-5-propoxyaniline
CasNumber: 1365272-85-0
MolecularFormula: C12H17BrN2O3
MolecularWeight: 317.179
MdlNumber: MFCD16652556
Smiles: CCCOc1cc(NC(C)C)c(cc1Br)[N+](=O)[O-]
Complexity: 271
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 5
Xlogp3: 4.6
CatalogNumber:
AA49075
ChemicalName:
4-Bromo-N-isopropyl-2-nitro-5-propoxyaniline
CasNumber:
1365272-85-0
MolecularFormula:
C12H17BrN2O3
MolecularWeight:
317.179
MdlNumber:
MFCD16652556
Smiles:
CCCOc1cc(NC(C)C)c(cc1Br)[N+](=O)[O-]
Complexity:
271
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
5
Xlogp3:
4.6