AC73629
70375-79-0 | Methyl 1,5-diphenyl-1h-pyrazole-3-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AC73629
ChemicalName
Methyl 1,5-diphenyl-1h-pyrazole-3-carboxylate
CasNumber
70375-79-0
MolecularFormula
C17H14N2O2
MolecularWeight
278.3053
MdlNumber
MFCD23105656
Smiles
COC(=O)c1cc(n(n1)c1ccccc1)c1ccccc1
Complexity
349
Covalently-bondedUnitCount
1
HeavyAtomCount
21
HydrogenBondAcceptorCount
3
RotatableBondCount
4
Xlogp3
3.7
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CatalogNumber: AC73629
ChemicalName: Methyl 1,5-diphenyl-1h-pyrazole-3-carboxylate
CasNumber: 70375-79-0
MolecularFormula: C17H14N2O2
MolecularWeight: 278.3053
MdlNumber: MFCD23105656
Smiles: COC(=O)c1cc(n(n1)c1ccccc1)c1ccccc1
Complexity: 349
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 3
RotatableBondCount: 4
Xlogp3: 3.7
CatalogNumber:
AC73629
ChemicalName:
Methyl 1,5-diphenyl-1h-pyrazole-3-carboxylate
CasNumber:
70375-79-0
MolecularFormula:
C17H14N2O2
MolecularWeight:
278.3053
MdlNumber:
MFCD23105656
Smiles:
COC(=O)c1cc(n(n1)c1ccccc1)c1ccccc1
Complexity:
349
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
3
RotatableBondCount:
4
Xlogp3:
3.7
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Smiles: CN=c1nc(n(s1)c1ccccc1)c1ccccc1
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HeavyAtomCount: __
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Smiles:
CN=c1nc(n(s1)c1ccccc1)c1ccccc1
Complexity:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: COC(=O)C1=C(O)c2c(S(=O)(=O)N1)cc(s2)Cl
Complexity: __
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MolecularFormula:
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MolecularWeight:
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Smiles:
COC(=O)C1=C(O)c2c(S(=O)(=O)N1)cc(s2)Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
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__
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Smiles: COC(=O)[C@]1(c2cccc(c2)Oc2ccccc2)C(C1(C#N)C=C(Cl)Cl)(C)C
Complexity: __
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HeavyAtomCount: __
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Xlogp3: __
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__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)[C@]1(c2cccc(c2)Oc2ccccc2)C(C1(C#N)C=C(Cl)Cl)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__