AD70172
15409-48-0 | 5-Methyl-1,3-diphenyl-1H-pyrazole-4-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AD70172
ChemicalName
5-Methyl-1,3-diphenyl-1H-pyrazole-4-carboxylic acid
CasNumber
15409-48-0
MolecularFormula
C17H14N2O2
MolecularWeight
278.3053
MdlNumber
MFCD00510082
Smiles
OC(=O)c1c(nn(c1C)c1ccccc1)c1ccccc1
Complexity
362
Covalently-bondedUnitCount
1
HeavyAtomCount
21
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
3.5
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CatalogNumber: AD70172
ChemicalName: 5-Methyl-1,3-diphenyl-1H-pyrazole-4-carboxylic acid
CasNumber: 15409-48-0
MolecularFormula: C17H14N2O2
MolecularWeight: 278.3053
MdlNumber: MFCD00510082
Smiles: OC(=O)c1c(nn(c1C)c1ccccc1)c1ccccc1
Complexity: 362
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 3.5
CatalogNumber:
AD70172
ChemicalName:
5-Methyl-1,3-diphenyl-1H-pyrazole-4-carboxylic acid
CasNumber:
15409-48-0
MolecularFormula:
C17H14N2O2
MolecularWeight:
278.3053
MdlNumber:
MFCD00510082
Smiles:
OC(=O)c1c(nn(c1C)c1ccccc1)c1ccccc1
Complexity:
362
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
3.5
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Smiles: CCOC(=O)Cc1ncccc1[N+](=O)[O-]
Complexity: __
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Smiles:
CCOC(=O)Cc1ncccc1[N+](=O)[O-]
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Smiles: Cc1cc2c(C[C@@H](C(=O)O)N)c[nH]c2cc1
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Smiles:
Cc1cc2c(C[C@@H](C(=O)O)N)c[nH]c2cc1
Complexity:
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HeavyAtomCount:
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RotatableBondCount:
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Xlogp3:
__
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Smiles: CCOC(=O)CCCCc1ccc(cc1)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
CCOC(=O)CCCCc1ccc(cc1)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__