AC07113
874291-02-8 | 4-(3-Isopropylureido)phenylboronic acid, pinacol ester
Manufacturer: A2B Chem
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CatalogNumber
AC07113
ChemicalName
4-(3-Isopropylureido)phenylboronic acid, pinacol ester
CasNumber
874291-02-8
MolecularFormula
C16H25BN2O3
MolecularWeight
304.1923
MdlNumber
MFCD08689517
Smiles
CC(NC(=O)Nc1ccc(cc1)B1OC(C(O1)(C)C)(C)C)C
Complexity
388
Covalently-bondedUnitCount
1
HeavyAtomCount
22
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
3
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CatalogNumber: AC07113
ChemicalName: 4-(3-Isopropylureido)phenylboronic acid, pinacol ester
CasNumber: 874291-02-8
MolecularFormula: C16H25BN2O3
MolecularWeight: 304.1923
MdlNumber: MFCD08689517
Smiles: CC(NC(=O)Nc1ccc(cc1)B1OC(C(O1)(C)C)(C)C)C
Complexity: 388
Covalently-bondedUnitCount: 1
HeavyAtomCount: 22
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 3
CatalogNumber:
AC07113
ChemicalName:
4-(3-Isopropylureido)phenylboronic acid, pinacol ester
CasNumber:
874291-02-8
MolecularFormula:
C16H25BN2O3
MolecularWeight:
304.1923
MdlNumber:
MFCD08689517
Smiles:
CC(NC(=O)Nc1ccc(cc1)B1OC(C(O1)(C)C)(C)C)C
Complexity:
388
Covalently-bondedUnitCount:
1
HeavyAtomCount:
22
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
3
CatalogNumber: AC07114
ChemicalName: 4-(Pyrrolidinylcarbonylamino)phenylboronic acid, pinacol ester
CasNumber: 874290-95-6
MolecularFormula: C17H25BN2O3
MolecularWeight: 316.203
MdlNumber: MFCD08689514
Smiles: O=C(N1CCCC1)Nc1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Complexity: 425
Covalently-bondedUnitCount: 1
HeavyAtomCount: 23
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
CatalogNumber:
AC07114
ChemicalName:
4-(Pyrrolidinylcarbonylamino)phenylboronic acid, pinacol ester
CasNumber:
874290-95-6
MolecularFormula:
C17H25BN2O3
MolecularWeight:
316.203
MdlNumber:
MFCD08689514
Smiles:
O=C(N1CCCC1)Nc1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Complexity:
425
Covalently-bondedUnitCount:
1
HeavyAtomCount:
23
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
CatalogNumber: AC07115
ChemicalName: 2-Cyanopyridine-3-boronic acid
CasNumber: 874290-88-7
MolecularFormula: C6H5BN2O2
MolecularWeight: 147.9271
MdlNumber: MFCD08458475
Smiles: N#Cc1ncccc1B(O)O
Complexity: 177
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 1
CatalogNumber:
AC07115
ChemicalName:
2-Cyanopyridine-3-boronic acid
CasNumber:
874290-88-7
MolecularFormula:
C6H5BN2O2
MolecularWeight:
147.9271
MdlNumber:
MFCD08458475
Smiles:
N#Cc1ncccc1B(O)O
Complexity:
177
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
1
CatalogNumber: AC07116
ChemicalName: N-Methoxy-N-methyl 5-borono-2-fluorobenzamide
CasNumber: 874290-69-4
MolecularFormula: C9H11BFNO4
MolecularWeight: 226.9973
MdlNumber: MFCD08235106
Smiles: CON(C(=O)c1cc(ccc1F)B(O)O)C
Complexity: 254
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 3
CatalogNumber:
AC07116
ChemicalName:
N-Methoxy-N-methyl 5-borono-2-fluorobenzamide
CasNumber:
874290-69-4
MolecularFormula:
C9H11BFNO4
MolecularWeight:
226.9973
MdlNumber:
MFCD08235106
Smiles:
CON(C(=O)c1cc(ccc1F)B(O)O)C
Complexity:
254
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
3