AA93690
175201-94-2 | 4-Chloro-1,3-dimethyl-1h-pyrazolo[3,4-b]pyridine-5-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AA93690
ChemicalName
4-Chloro-1,3-dimethyl-1h-pyrazolo[3,4-b]pyridine-5-carboxylic acid
CasNumber
175201-94-2
MolecularFormula
C9H8ClN3O2
MolecularWeight
225.6317
MdlNumber
MFCD00067959
Smiles
OC(=O)c1cnc2c(c1Cl)c(C)nn2C
Complexity
276
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
1.4
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CatalogNumber: AA93690
ChemicalName: 4-Chloro-1,3-dimethyl-1h-pyrazolo[3,4-b]pyridine-5-carboxylic acid
CasNumber: 175201-94-2
MolecularFormula: C9H8ClN3O2
MolecularWeight: 225.6317
MdlNumber: MFCD00067959
Smiles: OC(=O)c1cnc2c(c1Cl)c(C)nn2C
Complexity: 276
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 1.4
CatalogNumber:
AA93690
ChemicalName:
4-Chloro-1,3-dimethyl-1h-pyrazolo[3,4-b]pyridine-5-carboxylic acid
CasNumber:
175201-94-2
MolecularFormula:
C9H8ClN3O2
MolecularWeight:
225.6317
MdlNumber:
MFCD00067959
Smiles:
OC(=O)c1cnc2c(c1Cl)c(C)nn2C
Complexity:
276
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
1.4
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Smiles: Nc1cccc(c1)c1ccnc(n1)C
Complexity: __
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Smiles:
Nc1cccc(c1)c1ccnc(n1)C
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Smiles: OC(=O)c1scc(c1N)S(=O)(=O)C(C)C
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Smiles:
OC(=O)c1scc(c1N)S(=O)(=O)C(C)C
Complexity:
__
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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Smiles: CSCC[C@@H](C(=O)N(C(=O)c1ccc(cc1)C(F)(F)F)N)N
Complexity: __
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Smiles:
CSCC[C@@H](C(=O)N(C(=O)c1ccc(cc1)C(F)(F)F)N)N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
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