AG66581
65476-24-6 | 2-(4-(1H-pyrazol-1-yl)phenyl)acetic acid
Manufacturer: A2B Chem
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CatalogNumber
AG66581
ChemicalName
2-(4-(1H-pyrazol-1-yl)phenyl)acetic acid
CasNumber
65476-24-6
MolecularFormula
C11H10N2O2
MolecularWeight
202.2093
MdlNumber
MFCD11100034
Smiles
OC(=O)Cc1ccc(cc1)n1cccn1
Complexity
225
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
1.7
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CatalogNumber: AG66581
ChemicalName: 2-(4-(1H-pyrazol-1-yl)phenyl)acetic acid
CasNumber: 65476-24-6
MolecularFormula: C11H10N2O2
MolecularWeight: 202.2093
MdlNumber: MFCD11100034
Smiles: OC(=O)Cc1ccc(cc1)n1cccn1
Complexity: 225
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 1.7
CatalogNumber:
AG66581
ChemicalName:
2-(4-(1H-pyrazol-1-yl)phenyl)acetic acid
CasNumber:
65476-24-6
MolecularFormula:
C11H10N2O2
MolecularWeight:
202.2093
MdlNumber:
MFCD11100034
Smiles:
OC(=O)Cc1ccc(cc1)n1cccn1
Complexity:
225
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
1.7
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MolecularFormula: __
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Smiles: CCOC(=O)c1cc2c(s1)nccc2
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
CCOC(=O)c1cc2c(s1)nccc2
Complexity:
__
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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__
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Smiles: NC(=N)Cc1ccc(cc1)Br
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Smiles:
NC(=N)Cc1ccc(cc1)Br
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: Fc1ccccc1c1n[nH]c(=N)s1
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
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MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
Fc1ccccc1c1n[nH]c(=N)s1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__