AE15344
1036248-62-0 | 4-[4-(1H-Pyrazol-4-yl)phenyl]-1H-pyrazole
Manufacturer: A2B Chem
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CatalogNumber
AE15344
ChemicalName
4-[4-(1H-Pyrazol-4-yl)phenyl]-1H-pyrazole
CasNumber
1036248-62-0
MolecularFormula
C12H10N4
MolecularWeight
210.2346
MdlNumber
MFCD23704797
Smiles
n1[nH]cc(c1)c1ccc(cc1)c1c[nH]nc1
Complexity
201
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
2
RotatableBondCount
2
Xlogp3
1.8
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CatalogNumber: AE15344
ChemicalName: 4-[4-(1H-Pyrazol-4-yl)phenyl]-1H-pyrazole
CasNumber: 1036248-62-0
MolecularFormula: C12H10N4
MolecularWeight: 210.2346
MdlNumber: MFCD23704797
Smiles: n1[nH]cc(c1)c1ccc(cc1)c1c[nH]nc1
Complexity: 201
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 2
RotatableBondCount: 2
Xlogp3: 1.8
CatalogNumber:
AE15344
ChemicalName:
4-[4-(1H-Pyrazol-4-yl)phenyl]-1H-pyrazole
CasNumber:
1036248-62-0
MolecularFormula:
C12H10N4
MolecularWeight:
210.2346
MdlNumber:
MFCD23704797
Smiles:
n1[nH]cc(c1)c1ccc(cc1)c1c[nH]nc1
Complexity:
201
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
2
RotatableBondCount:
2
Xlogp3:
1.8
CatalogNumber: __
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Smiles: Clc1cc2scnc2cc1Cl
Complexity: __
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RotatableBondCount: __
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Smiles:
Clc1cc2scnc2cc1Cl
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Smiles: CCCc1nc(c(n1Cc1ccc(cc1)c1ccccc1c1n[nH]nn1)C(=O)O)C(C([2H])([2H])[2H])(C([2H])([2H])[2H])O
Complexity: __
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Smiles:
CCCc1nc(c(n1Cc1ccc(cc1)c1ccccc1c1n[nH]nn1)C(=O)O)C(C([2H])([2H])[2H])(C([2H])([2H])[2H])O
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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Smiles: COc1cc(/C=C/C(=C/C(=O)/C=C/c2ccc(c(c2)OC)O[Si](C(C)(C)C)(C)C)/O)ccc1O[Si](C(C)(C)C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1cc(/C=C/C(=C/C(=O)/C=C/c2ccc(c(c2)OC)O[Si](C(C)(C)C)(C)C)/O)ccc1O[Si](C(C)(C)C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__