AB56659
830-93-3 | 5-Bromogramine
Manufacturer: A2B Chem
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CatalogNumber
AB56659
ChemicalName
5-Bromogramine
CasNumber
830-93-3
MolecularFormula
C11H13BrN2
MolecularWeight
253.1383
MdlNumber
MFCD00055980
Smiles
CN(Cc1c[nH]c2c1cc(Br)cc2)C
NscNumber
73386
Complexity
196
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
1
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
1.8
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CatalogNumber: AB56659
ChemicalName: 5-Bromogramine
CasNumber: 830-93-3
MolecularFormula: C11H13BrN2
MolecularWeight: 253.1383
MdlNumber: MFCD00055980
Smiles: CN(Cc1c[nH]c2c1cc(Br)cc2)C
NscNumber: 73386
Complexity: 196
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 1.8
CatalogNumber:
AB56659
ChemicalName:
5-Bromogramine
CasNumber:
830-93-3
MolecularFormula:
C11H13BrN2
MolecularWeight:
253.1383
MdlNumber:
MFCD00055980
Smiles:
CN(Cc1c[nH]c2c1cc(Br)cc2)C
NscNumber:
73386
Complexity:
196
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
1.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(C(Cl)(Cl)Cl)c1ccc([nH]1)Br
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(C(Cl)(Cl)Cl)c1ccc([nH]1)Br
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB56661
ChemicalName: 1-(5-Bromo-2-fluoropyridin-3-yl)ethanone
CasNumber: 1111637-74-1
MolecularFormula: C7H5BrFNO
MolecularWeight: 218.0231032
MdlNumber: MFCD12024449
Smiles: Brc1cnc(c(c1)C(=O)C)F
NscNumber: __
Complexity: 165
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: __
RotatableBondCount: 1
Xlogp3: 1.7
CatalogNumber:
AB56661
ChemicalName:
1-(5-Bromo-2-fluoropyridin-3-yl)ethanone
CasNumber:
1111637-74-1
MolecularFormula:
C7H5BrFNO
MolecularWeight:
218.0231032
MdlNumber:
MFCD12024449
Smiles:
Brc1cnc(c(c1)C(=O)C)F
NscNumber:
__
Complexity:
165
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
__
RotatableBondCount:
1
Xlogp3:
1.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCN(/C=C/C(=O)c1cc(Br)ccc1O)CC
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCN(/C=C/C(=O)c1cc(Br)ccc1O)CC
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__