AI44896
21254-15-9 | 4-Chloro-1-isopropyl-1H-pyrazolo[3,4-d]pyrimidine
Manufacturer: A2B Chem
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CatalogNumber
AI44896
ChemicalName
4-Chloro-1-isopropyl-1H-pyrazolo[3,4-d]pyrimidine
CasNumber
21254-15-9
MolecularFormula
C8H9ClN4
MolecularWeight
196.63686
MdlNumber
MFCD14609284
Smiles
Clc1ncnc2c1cnn2C(C)C
Complexity
187
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
3
RotatableBondCount
1
Xlogp3
1.8
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CatalogNumber: AI44896
ChemicalName: 4-Chloro-1-isopropyl-1H-pyrazolo[3,4-d]pyrimidine
CasNumber: 21254-15-9
MolecularFormula: C8H9ClN4
MolecularWeight: 196.63686
MdlNumber: MFCD14609284
Smiles: Clc1ncnc2c1cnn2C(C)C
Complexity: 187
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
RotatableBondCount: 1
Xlogp3: 1.8
CatalogNumber:
AI44896
ChemicalName:
4-Chloro-1-isopropyl-1H-pyrazolo[3,4-d]pyrimidine
CasNumber:
21254-15-9
MolecularFormula:
C8H9ClN4
MolecularWeight:
196.63686
MdlNumber:
MFCD14609284
Smiles:
Clc1ncnc2c1cnn2C(C)C
Complexity:
187
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
RotatableBondCount:
1
Xlogp3:
1.8
CatalogNumber: __
ChemicalName: __
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MolecularFormula: __
MolecularWeight: __
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Smiles: Clc1nc(Cl)c2c(n1)n(nc2)C(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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__
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CasNumber:
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MolecularFormula:
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Smiles:
Clc1nc(Cl)c2c(n1)n(nc2)C(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
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__
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Smiles: CC(CC(=O)O[C@H]1C[C@@]2(COC(=O)C)C(C=C1C)OC1C3([C@]2(C)C(OC(=O)C)C1O)CO3)C
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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MolecularFormula:
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MolecularWeight:
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Smiles:
CC(CC(=O)O[C@H]1C[C@@]2(COC(=O)C)C(C=C1C)OC1C3([C@]2(C)C(OC(=O)C)C1O)CO3)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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ChemicalName: __
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Smiles: C1CCC(C(C1)NCc1ccccc1)NCc1ccccc1.Cl.Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
C1CCC(C(C1)NCc1ccccc1)NCc1ccccc1.Cl.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__