AA53961
1217501-23-9 | 3-(N-Isopropyl-N-(4-methoxybenzyl)sulfamoyl)phenylboronic acid
Manufacturer: A2B Chem
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CatalogNumber
AA53961
ChemicalName
3-(N-Isopropyl-N-(4-methoxybenzyl)sulfamoyl)phenylboronic acid
CasNumber
1217501-23-9
MolecularFormula
C17H22BNO5S
MolecularWeight
363.2363
MdlNumber
MFCD12756420
Smiles
COc1ccc(cc1)CN(S(=O)(=O)c1cccc(c1)B(O)O)C(C)C
Complexity
500
Covalently-bondedUnitCount
1
HeavyAtomCount
25
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
2
RotatableBondCount
7
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CatalogNumber: AA53961
ChemicalName: 3-(N-Isopropyl-N-(4-methoxybenzyl)sulfamoyl)phenylboronic acid
CasNumber: 1217501-23-9
MolecularFormula: C17H22BNO5S
MolecularWeight: 363.2363
MdlNumber: MFCD12756420
Smiles: COc1ccc(cc1)CN(S(=O)(=O)c1cccc(c1)B(O)O)C(C)C
Complexity: 500
Covalently-bondedUnitCount: 1
HeavyAtomCount: 25
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 2
RotatableBondCount: 7
CatalogNumber:
AA53961
ChemicalName:
3-(N-Isopropyl-N-(4-methoxybenzyl)sulfamoyl)phenylboronic acid
CasNumber:
1217501-23-9
MolecularFormula:
C17H22BNO5S
MolecularWeight:
363.2363
MdlNumber:
MFCD12756420
Smiles:
COc1ccc(cc1)CN(S(=O)(=O)c1cccc(c1)B(O)O)C(C)C
Complexity:
500
Covalently-bondedUnitCount:
1
HeavyAtomCount:
25
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
2
RotatableBondCount:
7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OB(c1cccc(c1)S(=O)(=O)N(C(C)(C)C)C)O
Complexity: 372
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OB(c1cccc(c1)S(=O)(=O)N(C(C)(C)C)C)O
Complexity:
372
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(Cn1ncc(c1)B(O)O)OCC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
CCOC(Cn1ncc(c1)B(O)O)OCC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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CatalogNumber: AA53965
ChemicalName: 4-Fluoro-3-(tetrahydro-2H-pyran-2-yloxy)phenylboronic acid
CasNumber: 1217501-17-1
MolecularFormula: C11H14BFO4
MolecularWeight: 240.0359
MdlNumber: MFCD13195650
Smiles: Fc1ccc(cc1OC1CCCCO1)B(O)O
Complexity: 242
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 3
CatalogNumber:
AA53965
ChemicalName:
4-Fluoro-3-(tetrahydro-2H-pyran-2-yloxy)phenylboronic acid
CasNumber:
1217501-17-1
MolecularFormula:
C11H14BFO4
MolecularWeight:
240.0359
MdlNumber:
MFCD13195650
Smiles:
Fc1ccc(cc1OC1CCCCO1)B(O)O
Complexity:
242
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
3