AB98049
886547-94-0 | 1-(Phenylsulfonyl)-7-azaindole-3-boronic acid, poinacol ester
Manufacturer: A2B Chem
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CatalogNumber
AB98049
ChemicalName
1-(Phenylsulfonyl)-7-azaindole-3-boronic acid, poinacol ester
CasNumber
886547-94-0
MolecularFormula
C19H21BN2O4S
MolecularWeight
384.257
MdlNumber
MFCD09999194
Smiles
CC1(C)OB(OC1(C)C)c1cn(c2c1cccn2)S(=O)(=O)c1ccccc1
Complexity
641
Covalently-bondedUnitCount
1
HeavyAtomCount
27
HydrogenBondAcceptorCount
5
RotatableBondCount
3
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CatalogNumber: AB98049
ChemicalName: 1-(Phenylsulfonyl)-7-azaindole-3-boronic acid, poinacol ester
CasNumber: 886547-94-0
MolecularFormula: C19H21BN2O4S
MolecularWeight: 384.257
MdlNumber: MFCD09999194
Smiles: CC1(C)OB(OC1(C)C)c1cn(c2c1cccn2)S(=O)(=O)c1ccccc1
Complexity: 641
Covalently-bondedUnitCount: 1
HeavyAtomCount: 27
HydrogenBondAcceptorCount: 5
RotatableBondCount: 3
CatalogNumber:
AB98049
ChemicalName:
1-(Phenylsulfonyl)-7-azaindole-3-boronic acid, poinacol ester
CasNumber:
886547-94-0
MolecularFormula:
C19H21BN2O4S
MolecularWeight:
384.257
MdlNumber:
MFCD09999194
Smiles:
CC1(C)OB(OC1(C)C)c1cn(c2c1cccn2)S(=O)(=O)c1ccccc1
Complexity:
641
Covalently-bondedUnitCount:
1
HeavyAtomCount:
27
HydrogenBondAcceptorCount:
5
RotatableBondCount:
3
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Smiles: CC(=O)c1ccc(s1)c1ccc(s1)C(=O)O
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CC(=O)c1ccc(s1)c1ccc(s1)C(=O)O
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Smiles: CN(CCNC(=O)C1CCNCC1)C.Cl.Cl
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CN(CCNC(=O)C1CCNCC1)C.Cl.Cl
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Smiles: Fc1cc(cc(c1)F)C1CCCN1
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Smiles:
Fc1cc(cc(c1)F)C1CCCN1
Complexity:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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