AB77513
941294-16-2 | N-Isopropyl 3-bromo-5-nitrobenzamide
Manufacturer: A2B Chem
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CatalogNumber
AB77513
ChemicalName
N-Isopropyl 3-bromo-5-nitrobenzamide
CasNumber
941294-16-2
MolecularFormula
C10H11BrN2O3
MolecularWeight
287.1099
MdlNumber
MFCD09475855
Smiles
CC(NC(=O)c1cc(Br)cc(c1)[N+](=O)[O-])C
Complexity
278
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
2.5
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CatalogNumber: AB77513
ChemicalName: N-Isopropyl 3-bromo-5-nitrobenzamide
CasNumber: 941294-16-2
MolecularFormula: C10H11BrN2O3
MolecularWeight: 287.1099
MdlNumber: MFCD09475855
Smiles: CC(NC(=O)c1cc(Br)cc(c1)[N+](=O)[O-])C
Complexity: 278
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2.5
CatalogNumber:
AB77513
ChemicalName:
N-Isopropyl 3-bromo-5-nitrobenzamide
CasNumber:
941294-16-2
MolecularFormula:
C10H11BrN2O3
MolecularWeight:
287.1099
MdlNumber:
MFCD09475855
Smiles:
CC(NC(=O)c1cc(Br)cc(c1)[N+](=O)[O-])C
Complexity:
278
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(NC(=O)c1cccc(c1)F)C
Complexity: 182
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 2.7
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(NC(=O)c1cccc(c1)F)C
Complexity:
182
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
2.7
CatalogNumber: AB77515
ChemicalName: N-Isopropyl 4-bromo-3-methoxybenzamide
CasNumber: 1072944-42-3
MolecularFormula: C11H14BrNO2
MolecularWeight: 272.1384
MdlNumber: MFCD11504877
Smiles: COc1cc(ccc1Br)C(=O)NC(C)C
Complexity: 221
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 2.7
CatalogNumber:
AB77515
ChemicalName:
N-Isopropyl 4-bromo-3-methoxybenzamide
CasNumber:
1072944-42-3
MolecularFormula:
C11H14BrNO2
MolecularWeight:
272.1384
MdlNumber:
MFCD11504877
Smiles:
COc1cc(ccc1Br)C(=O)NC(C)C
Complexity:
221
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
2.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(NC(=O)c1ccc(cc1)F)C
Complexity: 174
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 2.1
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(NC(=O)c1ccc(cc1)F)C
Complexity:
174
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
2.1