AD86572
886368-29-2 | 1-Boc-5-fluoro-3-indazole-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AD86572
ChemicalName
1-Boc-5-fluoro-3-indazole-carboxylic acid
CasNumber
886368-29-2
MolecularFormula
C13H13FN2O4
MolecularWeight
280.2517
MdlNumber
MFCD03840730
Smiles
Fc1ccc2c(c1)c(nn2C(=O)OC(C)(C)C)C(=O)O
Complexity
410
Covalently-bondedUnitCount
1
HeavyAtomCount
20
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
2.8
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CatalogNumber: AD86572
ChemicalName: 1-Boc-5-fluoro-3-indazole-carboxylic acid
CasNumber: 886368-29-2
MolecularFormula: C13H13FN2O4
MolecularWeight: 280.2517
MdlNumber: MFCD03840730
Smiles: Fc1ccc2c(c1)c(nn2C(=O)OC(C)(C)C)C(=O)O
Complexity: 410
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 2.8
CatalogNumber:
AD86572
ChemicalName:
1-Boc-5-fluoro-3-indazole-carboxylic acid
CasNumber:
886368-29-2
MolecularFormula:
C13H13FN2O4
MolecularWeight:
280.2517
MdlNumber:
MFCD03840730
Smiles:
Fc1ccc2c(c1)c(nn2C(=O)OC(C)(C)C)C(=O)O
Complexity:
410
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
2.8
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Smiles: Cc1cc(C)c2c(c1)C(=O)CCCN2
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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Xlogp3: __
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Smiles:
Cc1cc(C)c2c(c1)C(=O)CCCN2
Complexity:
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Smiles: Nc1ccc2c(c1)CNCCN2
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Smiles:
Nc1ccc2c(c1)CNCCN2
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HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: COC(=O)C(CN1CCN(CC1)C(=O)OC(C)(C)C)C
Complexity: __
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HeavyAtomCount: __
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ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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Smiles:
COC(=O)C(CN1CCN(CC1)C(=O)OC(C)(C)C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
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Xlogp3:
__