AB65732
874297-84-4 | 4-(3-Methoxy-3-methylureido)phenylboronic acid, pinacol ester
Manufacturer: A2B Chem
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CatalogNumber
AB65732
ChemicalName
4-(3-Methoxy-3-methylureido)phenylboronic acid, pinacol ester
CasNumber
874297-84-4
MolecularFormula
C15H23BN2O4
MolecularWeight
306.1651
MdlNumber
MFCD09027291
Smiles
CON(C(=O)Nc1ccc(cc1)B1OC(C(O1)(C)C)(C)C)C
Complexity
392
Covalently-bondedUnitCount
1
HeavyAtomCount
22
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
3
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CatalogNumber: AB65732
ChemicalName: 4-(3-Methoxy-3-methylureido)phenylboronic acid, pinacol ester
CasNumber: 874297-84-4
MolecularFormula: C15H23BN2O4
MolecularWeight: 306.1651
MdlNumber: MFCD09027291
Smiles: CON(C(=O)Nc1ccc(cc1)B1OC(C(O1)(C)C)(C)C)C
Complexity: 392
Covalently-bondedUnitCount: 1
HeavyAtomCount: 22
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 3
CatalogNumber:
AB65732
ChemicalName:
4-(3-Methoxy-3-methylureido)phenylboronic acid, pinacol ester
CasNumber:
874297-84-4
MolecularFormula:
C15H23BN2O4
MolecularWeight:
306.1651
MdlNumber:
MFCD09027291
Smiles:
CON(C(=O)Nc1ccc(cc1)B1OC(C(O1)(C)C)(C)C)C
Complexity:
392
Covalently-bondedUnitCount:
1
HeavyAtomCount:
22
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Nc1ccc(cc1)c1onc(n1)C
Complexity: 168
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Nc1ccc(cc1)c1onc(n1)C
Complexity:
168
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
CatalogNumber: AB65734
ChemicalName: 5-Methyl-6-morpholinylpyridine-3-boronic acid pinacol ester
CasNumber: 1073372-03-8
MolecularFormula: C16H25BN2O3
MolecularWeight: 304.1923
MdlNumber: MFCD09037483
Smiles: Cc1cc(cnc1N1CCOCC1)B1OC(C(O1)(C)C)(C)C
Complexity: 383
Covalently-bondedUnitCount: 1
HeavyAtomCount: 22
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: __
RotatableBondCount: 2
CatalogNumber:
AB65734
ChemicalName:
5-Methyl-6-morpholinylpyridine-3-boronic acid pinacol ester
CasNumber:
1073372-03-8
MolecularFormula:
C16H25BN2O3
MolecularWeight:
304.1923
MdlNumber:
MFCD09037483
Smiles:
Cc1cc(cnc1N1CCOCC1)B1OC(C(O1)(C)C)(C)C
Complexity:
383
Covalently-bondedUnitCount:
1
HeavyAtomCount:
22
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
__
RotatableBondCount:
2
CatalogNumber: AB65735
ChemicalName: 4-(3-Methyl-5-oxo-2-pyrazolin-1-yl)benzoic acid
CasNumber: 60875-16-3
MolecularFormula: C11H10N2O3
MolecularWeight: 218.2087
MdlNumber: MFCD00003135
Smiles: OC(=O)c1ccc(cc1)N1N=C(CC1=O)C
Complexity: 343
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 2
CatalogNumber:
AB65735
ChemicalName:
4-(3-Methyl-5-oxo-2-pyrazolin-1-yl)benzoic acid
CasNumber:
60875-16-3
MolecularFormula:
C11H10N2O3
MolecularWeight:
218.2087
MdlNumber:
MFCD00003135
Smiles:
OC(=O)c1ccc(cc1)N1N=C(CC1=O)C
Complexity:
343
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
2