AB65595
864754-20-1 | 1-(4-Pyridinomethyl)pyrazole-4-boronic acid pinacol ester
Manufacturer: A2B Chem
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CatalogNumber
AB65595
ChemicalName
1-(4-Pyridinomethyl)pyrazole-4-boronic acid pinacol ester
CasNumber
864754-20-1
MolecularFormula
C15H20BN3O2
MolecularWeight
285.1492
MdlNumber
MFCD08706028
Smiles
CC1(C)OB(OC1(C)C)c1cnn(c1)Cc1ccncc1
Complexity
356
Covalently-bondedUnitCount
1
HeavyAtomCount
21
HydrogenBondAcceptorCount
4
RotatableBondCount
3
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CatalogNumber: AB65595
ChemicalName: 1-(4-Pyridinomethyl)pyrazole-4-boronic acid pinacol ester
CasNumber: 864754-20-1
MolecularFormula: C15H20BN3O2
MolecularWeight: 285.1492
MdlNumber: MFCD08706028
Smiles: CC1(C)OB(OC1(C)C)c1cnn(c1)Cc1ccncc1
Complexity: 356
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 4
RotatableBondCount: 3
CatalogNumber:
AB65595
ChemicalName:
1-(4-Pyridinomethyl)pyrazole-4-boronic acid pinacol ester
CasNumber:
864754-20-1
MolecularFormula:
C15H20BN3O2
MolecularWeight:
285.1492
MdlNumber:
MFCD08706028
Smiles:
CC1(C)OB(OC1(C)C)c1cnn(c1)Cc1ccncc1
Complexity:
356
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
4
RotatableBondCount:
3
CatalogNumber: AB65596
ChemicalName: 4-Bromo-1-(4-morpholinosulfonylphenyl)pyrazole
CasNumber: 1187385-89-2
MolecularFormula: C13H14BrN3O3S
MolecularWeight: 372.2376
MdlNumber: MFCD12913971
Smiles: Brc1cnn(c1)c1ccc(cc1)S(=O)(=O)N1CCOCC1
Complexity: 442
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 5
RotatableBondCount: 3
CatalogNumber:
AB65596
ChemicalName:
4-Bromo-1-(4-morpholinosulfonylphenyl)pyrazole
CasNumber:
1187385-89-2
MolecularFormula:
C13H14BrN3O3S
MolecularWeight:
372.2376
MdlNumber:
MFCD12913971
Smiles:
Brc1cnn(c1)c1ccc(cc1)S(=O)(=O)N1CCOCC1
Complexity:
442
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
5
RotatableBondCount:
3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC1(C)OB(OC1(C)C)c1ccc(s1)CN1CCOCC1
Complexity: 358
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC1(C)OB(OC1(C)C)c1ccc(s1)CN1CCOCC1
Complexity:
358
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
CatalogNumber: AB65598
ChemicalName: Amodiaquine dihydrochloride
CasNumber: 69-44-3
MolecularFormula: C20H24Cl3N3O
MolecularWeight: 428.7831
MdlNumber: MFCD00078857
Smiles: CCN(Cc1cc(ccc1O)Nc1ccnc2c1ccc(c2)Cl)CC.Cl.Cl
Complexity: 406
Covalently-bondedUnitCount: 3
HeavyAtomCount: 27
HydrogenBondAcceptorCount: 4
RotatableBondCount: 6
CatalogNumber:
AB65598
ChemicalName:
Amodiaquine dihydrochloride
CasNumber:
69-44-3
MolecularFormula:
C20H24Cl3N3O
MolecularWeight:
428.7831
MdlNumber:
MFCD00078857
Smiles:
CCN(Cc1cc(ccc1O)Nc1ccnc2c1ccc(c2)Cl)CC.Cl.Cl
Complexity:
406
Covalently-bondedUnitCount:
3
HeavyAtomCount:
27
HydrogenBondAcceptorCount:
4
RotatableBondCount:
6