AB68741
51649-80-0 | 5-Amino-1-phenyl-1h-pyrazole-4-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AB68741
ChemicalName
5-Amino-1-phenyl-1h-pyrazole-4-carboxylic acid
CasNumber
51649-80-0
MolecularFormula
C10H9N3O2
MolecularWeight
203.1974
MdlNumber
MFCD00220607
Smiles
OC(=O)c1cnn(c1N)c1ccccc1
Complexity
241
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
2
Xlogp3
1.6
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CatalogNumber: AB68741
ChemicalName: 5-Amino-1-phenyl-1h-pyrazole-4-carboxylic acid
CasNumber: 51649-80-0
MolecularFormula: C10H9N3O2
MolecularWeight: 203.1974
MdlNumber: MFCD00220607
Smiles: OC(=O)c1cnn(c1N)c1ccccc1
Complexity: 241
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 2
Xlogp3: 1.6
CatalogNumber:
AB68741
ChemicalName:
5-Amino-1-phenyl-1h-pyrazole-4-carboxylic acid
CasNumber:
51649-80-0
MolecularFormula:
C10H9N3O2
MolecularWeight:
203.1974
MdlNumber:
MFCD00220607
Smiles:
OC(=O)c1cnn(c1N)c1ccccc1
Complexity:
241
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
2
Xlogp3:
1.6
CatalogNumber: AB68742
ChemicalName: 5-Amino-1-phenylpyrazole-4-carbonitrile
CasNumber: 5334-43-0
MolecularFormula: C10H8N4
MolecularWeight: 184.1973
MdlNumber: MFCD00020730
Smiles: N#Cc1cnn(c1N)c1ccccc1
Complexity: 238
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 1.8
CatalogNumber:
AB68742
ChemicalName:
5-Amino-1-phenylpyrazole-4-carbonitrile
CasNumber:
5334-43-0
MolecularFormula:
C10H8N4
MolecularWeight:
184.1973
MdlNumber:
MFCD00020730
Smiles:
N#Cc1cnn(c1N)c1ccccc1
Complexity:
238
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
1.8
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Smiles: Nc1ccc(nc1)Oc1ccc(cc1Cl)Cl
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Smiles:
Nc1ccc(nc1)Oc1ccc(cc1Cl)Cl
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Smiles: Nc1ccc(cc1)c1oc2c(c1)cc(cc2)N
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Smiles:
Nc1ccc(cc1)c1oc2c(c1)cc(cc2)N
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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