AB68720
1072944-83-2 | 5-Amino-4-cyano-1-(2-fluorophenyl)-3-methylpyrazole
Manufacturer: A2B Chem
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CatalogNumber
AB68720
ChemicalName
5-Amino-4-cyano-1-(2-fluorophenyl)-3-methylpyrazole
CasNumber
1072944-83-2
MolecularFormula
C11H9FN4
MolecularWeight
216.2144
MdlNumber
MFCD10699687
Smiles
N#Cc1c(C)nn(c1N)c1ccccc1F
Complexity
300
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
2.3
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CatalogNumber: AB68720
ChemicalName: 5-Amino-4-cyano-1-(2-fluorophenyl)-3-methylpyrazole
CasNumber: 1072944-83-2
MolecularFormula: C11H9FN4
MolecularWeight: 216.2144
MdlNumber: MFCD10699687
Smiles: N#Cc1c(C)nn(c1N)c1ccccc1F
Complexity: 300
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 2.3
CatalogNumber:
AB68720
ChemicalName:
5-Amino-4-cyano-1-(2-fluorophenyl)-3-methylpyrazole
CasNumber:
1072944-83-2
MolecularFormula:
C11H9FN4
MolecularWeight:
216.2144
MdlNumber:
MFCD10699687
Smiles:
N#Cc1c(C)nn(c1N)c1ccccc1F
Complexity:
300
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
2.3
CatalogNumber: AB68721
ChemicalName: 5-Amino-1-(2-hydroxyethyl)pyrazole-4-carboxylic acid
CasNumber: 58046-50-7
MolecularFormula: C6H9N3O3
MolecularWeight: 171.154
MdlNumber: MFCD06496475
Smiles: OCCn1ncc(c1N)C(=O)O
Complexity: 175
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 3
RotatableBondCount: 3
Xlogp3: -0.8
CatalogNumber:
AB68721
ChemicalName:
5-Amino-1-(2-hydroxyethyl)pyrazole-4-carboxylic acid
CasNumber:
58046-50-7
MolecularFormula:
C6H9N3O3
MolecularWeight:
171.154
MdlNumber:
MFCD06496475
Smiles:
OCCn1ncc(c1N)C(=O)O
Complexity:
175
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
3
RotatableBondCount:
3
Xlogp3:
-0.8
CatalogNumber: AB68722
ChemicalName: 5-Amino-1-(2-hydroxyethyl)pyrazole
CasNumber: 73616-27-0
MolecularFormula: C5H9N3O
MolecularWeight: 127.1445
MdlNumber: MFCD08063809
Smiles: OCCn1nccc1N
Complexity: 88.3
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 2
Xlogp3: -0.9
CatalogNumber:
AB68722
ChemicalName:
5-Amino-1-(2-hydroxyethyl)pyrazole
CasNumber:
73616-27-0
MolecularFormula:
C5H9N3O
MolecularWeight:
127.1445
MdlNumber:
MFCD08063809
Smiles:
OCCn1nccc1N
Complexity:
88.3
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
2
Xlogp3:
-0.9
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Smiles: N#Cc1cnn(c1N)c1cccc(c1)Cl
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Smiles:
N#Cc1cnn(c1N)c1cccc(c1)Cl
Complexity:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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