AD78584
107842-57-9 | 5-Amino-4-cyano-1-(3-chlorophenyl)-3-methylpyrazole
Manufacturer: A2B Chem
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CatalogNumber
AD78584
ChemicalName
5-Amino-4-cyano-1-(3-chlorophenyl)-3-methylpyrazole
CasNumber
107842-57-9
MolecularFormula
C11H9ClN4
MolecularWeight
232.669
MdlNumber
MFCD11053835
Smiles
N#Cc1c(C)nn(c1N)c1cccc(c1)Cl
Complexity
300
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
2.8
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CatalogNumber: AD78584
ChemicalName: 5-Amino-4-cyano-1-(3-chlorophenyl)-3-methylpyrazole
CasNumber: 107842-57-9
MolecularFormula: C11H9ClN4
MolecularWeight: 232.669
MdlNumber: MFCD11053835
Smiles: N#Cc1c(C)nn(c1N)c1cccc(c1)Cl
Complexity: 300
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 2.8
CatalogNumber:
AD78584
ChemicalName:
5-Amino-4-cyano-1-(3-chlorophenyl)-3-methylpyrazole
CasNumber:
107842-57-9
MolecularFormula:
C11H9ClN4
MolecularWeight:
232.669
MdlNumber:
MFCD11053835
Smiles:
N#Cc1c(C)nn(c1N)c1cccc(c1)Cl
Complexity:
300
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
2.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: [O-][N+](=O)CCCOC1CCCCO1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
[O-][N+](=O)CCCOC1CCCCO1
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
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Xlogp3:
__
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ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(=CCCC1=CCC(C(C1)C(=O)O)C(=O)O)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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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:
CC(=CCCC1=CCC(C(C1)C(=O)O)C(=O)O)C
Complexity:
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Covalently-bondedUnitCount:
__
HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
__
CatalogNumber: AD78592
ChemicalName: Methyl 3-amino-5-bromothiophene-2-carboxylate
CasNumber: 107818-55-3
MolecularFormula: C6H6BrNO2S
MolecularWeight: 236.0863
MdlNumber: MFCD12031265
Smiles: COC(=O)c1sc(cc1N)Br
Complexity: 167
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2.7
CatalogNumber:
AD78592
ChemicalName:
Methyl 3-amino-5-bromothiophene-2-carboxylate
CasNumber:
107818-55-3
MolecularFormula:
C6H6BrNO2S
MolecularWeight:
236.0863
MdlNumber:
MFCD12031265
Smiles:
COC(=O)c1sc(cc1N)Br
Complexity:
167
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2.7