AA54465
1218789-36-6 | 2-(Methylsulfonylamino)pyrimidine-5-boronic acid, pinacol ester
Manufacturer: A2B Chem
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CatalogNumber
AA54465
ChemicalName
2-(Methylsulfonylamino)pyrimidine-5-boronic acid, pinacol ester
CasNumber
1218789-36-6
MolecularFormula
C11H18BN3O4S
MolecularWeight
299.1543
MdlNumber
MFCD12546566
Smiles
CS(=O)(=O)Nc1ncc(cn1)B1OC(C(O1)(C)C)(C)C
Complexity
439
Covalently-bondedUnitCount
1
HeavyAtomCount
20
HydrogenBondAcceptorCount
7
HydrogenBondDonorCount
1
RotatableBondCount
3
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CatalogNumber: AA54465
ChemicalName: 2-(Methylsulfonylamino)pyrimidine-5-boronic acid, pinacol ester
CasNumber: 1218789-36-6
MolecularFormula: C11H18BN3O4S
MolecularWeight: 299.1543
MdlNumber: MFCD12546566
Smiles: CS(=O)(=O)Nc1ncc(cn1)B1OC(C(O1)(C)C)(C)C
Complexity: 439
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 7
HydrogenBondDonorCount: 1
RotatableBondCount: 3
CatalogNumber:
AA54465
ChemicalName:
2-(Methylsulfonylamino)pyrimidine-5-boronic acid, pinacol ester
CasNumber:
1218789-36-6
MolecularFormula:
C11H18BN3O4S
MolecularWeight:
299.1543
MdlNumber:
MFCD12546566
Smiles:
CS(=O)(=O)Nc1ncc(cn1)B1OC(C(O1)(C)C)(C)C
Complexity:
439
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
7
HydrogenBondDonorCount:
1
RotatableBondCount:
3
CatalogNumber: AA54466
ChemicalName: 2-(Cyclohexylamino)pyrimidine-5-boronic acid, pinacol ester
CasNumber: 1218789-35-5
MolecularFormula: C16H26BN3O2
MolecularWeight: 303.2075
MdlNumber: MFCD00002706
Smiles: CC1(C)OB(OC1(C)C)c1cnc(nc1)NC1CCCCC1
Complexity: 362
Covalently-bondedUnitCount: 1
HeavyAtomCount: 22
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 3
CatalogNumber:
AA54466
ChemicalName:
2-(Cyclohexylamino)pyrimidine-5-boronic acid, pinacol ester
CasNumber:
1218789-35-5
MolecularFormula:
C16H26BN3O2
MolecularWeight:
303.2075
MdlNumber:
MFCD00002706
Smiles:
CC1(C)OB(OC1(C)C)c1cnc(nc1)NC1CCCCC1
Complexity:
362
Covalently-bondedUnitCount:
1
HeavyAtomCount:
22
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OCCNc1ncc(cn1)B1OC(C(O1)(C)C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
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CatalogNumber:
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ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
OCCNc1ncc(cn1)B1OC(C(O1)(C)C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
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CatalogNumber: AA54468
ChemicalName: 2-Cyclopropylaminopyrimidine-5-boronic acid, pinacol ester
CasNumber: 1218789-33-3
MolecularFormula: C13H20BN3O2
MolecularWeight: 261.1278
MdlNumber: MFCD07375178
Smiles: CC1(C)OB(OC1(C)C)c1cnc(nc1)NC1CC1
Complexity: 323
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 3
CatalogNumber:
AA54468
ChemicalName:
2-Cyclopropylaminopyrimidine-5-boronic acid, pinacol ester
CasNumber:
1218789-33-3
MolecularFormula:
C13H20BN3O2
MolecularWeight:
261.1278
MdlNumber:
MFCD07375178
Smiles:
CC1(C)OB(OC1(C)C)c1cnc(nc1)NC1CC1
Complexity:
323
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
3