AB47994
874290-98-9 | 4-(3-Benzylureido)phenylboronic acid, pinacol ester
Manufacturer: A2B Chem
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CatalogNumber
AB47994
ChemicalName
4-(3-Benzylureido)phenylboronic acid, pinacol ester
CasNumber
874290-98-9
MolecularFormula
C20H25BN2O3
MolecularWeight
352.2351
MdlNumber
MFCD08689513
Smiles
O=C(Nc1ccc(cc1)B1OC(C(O1)(C)C)(C)C)NCc1ccccc1
Complexity
467
Covalently-bondedUnitCount
1
HeavyAtomCount
26
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
4
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CatalogNumber: AB47994
ChemicalName: 4-(3-Benzylureido)phenylboronic acid, pinacol ester
CasNumber: 874290-98-9
MolecularFormula: C20H25BN2O3
MolecularWeight: 352.2351
MdlNumber: MFCD08689513
Smiles: O=C(Nc1ccc(cc1)B1OC(C(O1)(C)C)(C)C)NCc1ccccc1
Complexity: 467
Covalently-bondedUnitCount: 1
HeavyAtomCount: 26
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 4
CatalogNumber:
AB47994
ChemicalName:
4-(3-Benzylureido)phenylboronic acid, pinacol ester
CasNumber:
874290-98-9
MolecularFormula:
C20H25BN2O3
MolecularWeight:
352.2351
MdlNumber:
MFCD08689513
Smiles:
O=C(Nc1ccc(cc1)B1OC(C(O1)(C)C)(C)C)NCc1ccccc1
Complexity:
467
Covalently-bondedUnitCount:
1
HeavyAtomCount:
26
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
4
CatalogNumber: AB47995
ChemicalName: 5-(Cyclopropylcarbamoyl)-2-fluorophenylboronic acid
CasNumber: 874289-54-0
MolecularFormula: C10H11BFNO3
MolecularWeight: 223.0086
MdlNumber: MFCD11855834
Smiles: O=C(c1ccc(c(c1)B(O)O)F)NC1CC1
Complexity: 273
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 3
RotatableBondCount: 3
CatalogNumber:
AB47995
ChemicalName:
5-(Cyclopropylcarbamoyl)-2-fluorophenylboronic acid
CasNumber:
874289-54-0
MolecularFormula:
C10H11BFNO3
MolecularWeight:
223.0086
MdlNumber:
MFCD11855834
Smiles:
O=C(c1ccc(c(c1)B(O)O)F)NC1CC1
Complexity:
273
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
3
RotatableBondCount:
3
CatalogNumber: AB47996
ChemicalName: 2-Fluoro-5-(piperidine-1-carbonyl)phenylboronic acid
CasNumber: 874289-43-7
MolecularFormula: C12H15BFNO3
MolecularWeight: 251.0618
MdlNumber: MFCD08436068
Smiles: O=C(c1ccc(c(c1)B(O)O)F)N1CCCCC1
Complexity: 297
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 2
CatalogNumber:
AB47996
ChemicalName:
2-Fluoro-5-(piperidine-1-carbonyl)phenylboronic acid
CasNumber:
874289-43-7
MolecularFormula:
C12H15BFNO3
MolecularWeight:
251.0618
MdlNumber:
MFCD08436068
Smiles:
O=C(c1ccc(c(c1)B(O)O)F)N1CCCCC1
Complexity:
297
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
2
CatalogNumber: AB47997
ChemicalName: 4-Borono-3-fluorobenzamide
CasNumber: 874289-22-2
MolecularFormula: C7H7BFNO3
MolecularWeight: 182.9448
MdlNumber: MFCD09800867
Smiles: NC(=O)c1ccc(c(c1)F)B(O)O
Complexity: 202
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 3
RotatableBondCount: 2
CatalogNumber:
AB47997
ChemicalName:
4-Borono-3-fluorobenzamide
CasNumber:
874289-22-2
MolecularFormula:
C7H7BFNO3
MolecularWeight:
182.9448
MdlNumber:
MFCD09800867
Smiles:
NC(=O)c1ccc(c(c1)F)B(O)O
Complexity:
202
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
3
RotatableBondCount:
2