AA08035
1020252-77-0 | N-Isopropyl 4-bromo-3-methylbenzamide
Manufacturer: A2B Chem
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CatalogNumber
AA08035
ChemicalName
N-Isopropyl 4-bromo-3-methylbenzamide
CasNumber
1020252-77-0
MolecularFormula
C11H14BrNO
MolecularWeight
256.139
MdlNumber
MFCD09972122
Smiles
CC(NC(=O)c1ccc(c(c1)C)Br)C
Complexity
206
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
1
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
3.1
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CatalogNumber: AA08035
ChemicalName: N-Isopropyl 4-bromo-3-methylbenzamide
CasNumber: 1020252-77-0
MolecularFormula: C11H14BrNO
MolecularWeight: 256.139
MdlNumber: MFCD09972122
Smiles: CC(NC(=O)c1ccc(c(c1)C)Br)C
Complexity: 206
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 3.1
CatalogNumber:
AA08035
ChemicalName:
N-Isopropyl 4-bromo-3-methylbenzamide
CasNumber:
1020252-77-0
MolecularFormula:
C11H14BrNO
MolecularWeight:
256.139
MdlNumber:
MFCD09972122
Smiles:
CC(NC(=O)c1ccc(c(c1)C)Br)C
Complexity:
206
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
3.1
CatalogNumber: AA08036
ChemicalName: N-Benzyl 4-bromo-3-methylbenzamide
CasNumber: 1020252-76-9
MolecularFormula: C15H14BrNO
MolecularWeight: 304.1818
MdlNumber: MFCD09972121
Smiles: O=C(c1ccc(c(c1)C)Br)NCc1ccccc1
Complexity: 276
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 3.7
CatalogNumber:
AA08036
ChemicalName:
N-Benzyl 4-bromo-3-methylbenzamide
CasNumber:
1020252-76-9
MolecularFormula:
C15H14BrNO
MolecularWeight:
304.1818
MdlNumber:
MFCD09972121
Smiles:
O=C(c1ccc(c(c1)C)Br)NCc1ccccc1
Complexity:
276
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
3.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(C(C)(C)C)Nc1cc(Br)cc(c1)Br
Complexity: 227
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 3.9
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
O=C(C(C)(C)C)Nc1cc(Br)cc(c1)Br
Complexity:
227
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
3.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1ncc(c2n1nc(n2)S(=O)(=O)O)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1ncc(c2n1nc(n2)S(=O)(=O)O)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__