AB47947
874290-99-0 | 4-(3-Methylureido)phenylboronic acid, pinacol ester
Manufacturer: A2B Chem
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CatalogNumber
AB47947
ChemicalName
4-(3-Methylureido)phenylboronic acid, pinacol ester
CasNumber
874290-99-0
MolecularFormula
C14H21BN2O3
MolecularWeight
276.1391
MdlNumber
MFCD06795684
Smiles
CNC(=O)Nc1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Complexity
349
Covalently-bondedUnitCount
1
HeavyAtomCount
20
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
2
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CatalogNumber: AB47947
ChemicalName: 4-(3-Methylureido)phenylboronic acid, pinacol ester
CasNumber: 874290-99-0
MolecularFormula: C14H21BN2O3
MolecularWeight: 276.1391
MdlNumber: MFCD06795684
Smiles: CNC(=O)Nc1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Complexity: 349
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 2
CatalogNumber:
AB47947
ChemicalName:
4-(3-Methylureido)phenylboronic acid, pinacol ester
CasNumber:
874290-99-0
MolecularFormula:
C14H21BN2O3
MolecularWeight:
276.1391
MdlNumber:
MFCD06795684
Smiles:
CNC(=O)Nc1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Complexity:
349
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: N#Cc1cnccc1B(O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
N#Cc1cnccc1B(O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
CatalogNumber: AB47949
ChemicalName: N-Benzyl 3-borono-4-fluorobenzamide
CasNumber: 874289-53-9
MolecularFormula: C14H13BFNO3
MolecularWeight: 273.0673
MdlNumber: MFCD08436031
Smiles: O=C(c1ccc(c(c1)B(O)O)F)NCc1ccccc1
Complexity: 324
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 3
RotatableBondCount: 4
CatalogNumber:
AB47949
ChemicalName:
N-Benzyl 3-borono-4-fluorobenzamide
CasNumber:
874289-53-9
MolecularFormula:
C14H13BFNO3
MolecularWeight:
273.0673
MdlNumber:
MFCD08436031
Smiles:
O=C(c1ccc(c(c1)B(O)O)F)NCc1ccccc1
Complexity:
324
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
3
RotatableBondCount:
4
CatalogNumber: AB47950
ChemicalName: N-t-Butyl 3-borono-4-fluorobenzamide
CasNumber: 874289-51-7
MolecularFormula: C11H15BFNO3
MolecularWeight: 239.0511
MdlNumber: MFCD08436054
Smiles: O=C(c1ccc(c(c1)B(O)O)F)NC(C)(C)C
Complexity: 280
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 3
RotatableBondCount: 3
CatalogNumber:
AB47950
ChemicalName:
N-t-Butyl 3-borono-4-fluorobenzamide
CasNumber:
874289-51-7
MolecularFormula:
C11H15BFNO3
MolecularWeight:
239.0511
MdlNumber:
MFCD08436054
Smiles:
O=C(c1ccc(c(c1)B(O)O)F)NC(C)(C)C
Complexity:
280
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
3
RotatableBondCount:
3