AI14031
1214900-50-1 | 6-Bromo-3-methyl-1-(tetrahydro-2h-pyran-2-yl)-1h-indazole
Manufacturer: A2B Chem
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CatalogNumber
AI14031
ChemicalName
6-Bromo-3-methyl-1-(tetrahydro-2h-pyran-2-yl)-1h-indazole
CasNumber
1214900-50-1
MolecularFormula
C13H15BrN2O
MolecularWeight
295.175
MdlNumber
MFCD30185096
Smiles
Brc1ccc2c(c1)n(nc2C)C1CCCCO1
Complexity
276
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
2
RotatableBondCount
1
UndefinedAtomStereocenterCount
1
Xlogp3
3.4
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CatalogNumber: AI14031
ChemicalName: 6-Bromo-3-methyl-1-(tetrahydro-2h-pyran-2-yl)-1h-indazole
CasNumber: 1214900-50-1
MolecularFormula: C13H15BrN2O
MolecularWeight: 295.175
MdlNumber: MFCD30185096
Smiles: Brc1ccc2c(c1)n(nc2C)C1CCCCO1
Complexity: 276
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 2
RotatableBondCount: 1
UndefinedAtomStereocenterCount: 1
Xlogp3: 3.4
CatalogNumber:
AI14031
ChemicalName:
6-Bromo-3-methyl-1-(tetrahydro-2h-pyran-2-yl)-1h-indazole
CasNumber:
1214900-50-1
MolecularFormula:
C13H15BrN2O
MolecularWeight:
295.175
MdlNumber:
MFCD30185096
Smiles:
Brc1ccc2c(c1)n(nc2C)C1CCCCO1
Complexity:
276
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
2
RotatableBondCount:
1
UndefinedAtomStereocenterCount:
1
Xlogp3:
3.4
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Smiles: O=C(N1CCOc2c1ccc(n2)I)OC(C)(C)C
Complexity: __
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HydrogenBondAcceptorCount: __
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UndefinedAtomStereocenterCount: __
Xlogp3: __
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Smiles:
O=C(N1CCOc2c1ccc(n2)I)OC(C)(C)C
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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Xlogp3:
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Smiles: CC(NC(=O)OC(C)(C)C)CN1CCN(CC1)c1ccccn1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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Xlogp3: __
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MolecularFormula:
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Smiles:
CC(NC(=O)OC(C)(C)C)CN1CCN(CC1)c1ccccn1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
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Smiles: O=C1NCCCc2c1ccc(c2)B1OC(C(O1)(C)C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C1NCCCc2c1ccc(c2)B1OC(C(O1)(C)C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__