AB48659
654655-68-2 | 3-Benzyl-6-bromo-2-chloroquinoline
Manufacturer: A2B Chem
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CatalogNumber
AB48659
ChemicalName
3-Benzyl-6-bromo-2-chloroquinoline
CasNumber
654655-68-2
MolecularFormula
C16H11BrClN
MolecularWeight
332.6222
MdlNumber
MFCD22493487
Smiles
Brc1ccc2c(c1)cc(c(n2)Cl)Cc1ccccc1
Complexity
293
Covalently-bondedUnitCount
1
HeavyAtomCount
19
HydrogenBondAcceptorCount
1
RotatableBondCount
2
Xlogp3
5.8
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CatalogNumber: AB48659
ChemicalName: 3-Benzyl-6-bromo-2-chloroquinoline
CasNumber: 654655-68-2
MolecularFormula: C16H11BrClN
MolecularWeight: 332.6222
MdlNumber: MFCD22493487
Smiles: Brc1ccc2c(c1)cc(c(n2)Cl)Cc1ccccc1
Complexity: 293
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 1
RotatableBondCount: 2
Xlogp3: 5.8
CatalogNumber:
AB48659
ChemicalName:
3-Benzyl-6-bromo-2-chloroquinoline
CasNumber:
654655-68-2
MolecularFormula:
C16H11BrClN
MolecularWeight:
332.6222
MdlNumber:
MFCD22493487
Smiles:
Brc1ccc2c(c1)cc(c(n2)Cl)Cc1ccccc1
Complexity:
293
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
1
RotatableBondCount:
2
Xlogp3:
5.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1ccc2c(c1)ccc[n+]2[O-]
Complexity: 174
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 0.5
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1ccc2c(c1)ccc[n+]2[O-]
Complexity:
174
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
0.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)[C@H](Cc1ccc(cc1)OS(=O)(=O)[O-])N.[Na+]
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)[C@H](Cc1ccc(cc1)OS(=O)(=O)[O-])N.[Na+]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB48662
ChemicalName: (3-Amino-5-nitrophenyl)methanol
CasNumber: 90390-46-8
MolecularFormula: C7H8N2O3
MolecularWeight: 168.15
MdlNumber: MFCD08236778
Smiles: OCc1cc(N)cc(c1)[N+](=O)[O-]
Complexity: 169
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 4
RotatableBondCount: 1
Xlogp3: 0.2
CatalogNumber:
AB48662
ChemicalName:
(3-Amino-5-nitrophenyl)methanol
CasNumber:
90390-46-8
MolecularFormula:
C7H8N2O3
MolecularWeight:
168.15
MdlNumber:
MFCD08236778
Smiles:
OCc1cc(N)cc(c1)[N+](=O)[O-]
Complexity:
169
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
4
RotatableBondCount:
1
Xlogp3:
0.2