AD54248
1352318-23-0 | N-(4-Bromopyridin-2-yl)formamide
Manufacturer: A2B Chem
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CatalogNumber
AD54248
ChemicalName
N-(4-Bromopyridin-2-yl)formamide
CasNumber
1352318-23-0
MolecularFormula
C6H5BrN2O
MolecularWeight
201.0207
MdlNumber
MFCD20491450
Smiles
Brc1cc(NC=O)ncc1
Complexity
120
Covalently-bondedUnitCount
1
HeavyAtomCount
10
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
1.1
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CatalogNumber: AD54248
ChemicalName: N-(4-Bromopyridin-2-yl)formamide
CasNumber: 1352318-23-0
MolecularFormula: C6H5BrN2O
MolecularWeight: 201.0207
MdlNumber: MFCD20491450
Smiles: Brc1cc(NC=O)ncc1
Complexity: 120
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 1.1
CatalogNumber:
AD54248
ChemicalName:
N-(4-Bromopyridin-2-yl)formamide
CasNumber:
1352318-23-0
MolecularFormula:
C6H5BrN2O
MolecularWeight:
201.0207
MdlNumber:
MFCD20491450
Smiles:
Brc1cc(NC=O)ncc1
Complexity:
120
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
1.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(c1cc2ccccc2cc1OC)OC
Complexity: 228
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 2.8
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(c1cc2ccccc2cc1OC)OC
Complexity:
228
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
2.8
CatalogNumber: AD54250
ChemicalName: 2-(4-Fluoro-3-methoxyphenyl)benzonitrile
CasNumber: 1352318-04-7
MolecularFormula: C14H10FNO
MolecularWeight: 227.2337
MdlNumber: MFCD20529477
Smiles: COc1cc(ccc1F)c1ccccc1C#N
Complexity: 298
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: __
RotatableBondCount: 2
Xlogp3: 3.3
CatalogNumber:
AD54250
ChemicalName:
2-(4-Fluoro-3-methoxyphenyl)benzonitrile
CasNumber:
1352318-04-7
MolecularFormula:
C14H10FNO
MolecularWeight:
227.2337
MdlNumber:
MFCD20529477
Smiles:
COc1cc(ccc1F)c1ccccc1C#N
Complexity:
298
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
__
RotatableBondCount:
2
Xlogp3:
3.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1ccc(c(c1[N+](=O)[O-])F)Br
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1ccc(c(c1[N+](=O)[O-])F)Br
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__