AE04602
76982-35-9 | 5-Amino-1-(4-bromophenyl)-4-cyano-3-methyl-1H-pyrazole
Manufacturer: A2B Chem
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CatalogNumber
AE04602
ChemicalName
5-Amino-1-(4-bromophenyl)-4-cyano-3-methyl-1H-pyrazole
CasNumber
76982-35-9
MolecularFormula
C11H9BrN4
MolecularWeight
277.12
MdlNumber
MFCD08459269
Smiles
N#Cc1c(C)nn(c1N)c1ccc(cc1)Br
Complexity
292
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
2.9
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CatalogNumber: AE04602
ChemicalName: 5-Amino-1-(4-bromophenyl)-4-cyano-3-methyl-1H-pyrazole
CasNumber: 76982-35-9
MolecularFormula: C11H9BrN4
MolecularWeight: 277.12
MdlNumber: MFCD08459269
Smiles: N#Cc1c(C)nn(c1N)c1ccc(cc1)Br
Complexity: 292
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 2.9
CatalogNumber:
AE04602
ChemicalName:
5-Amino-1-(4-bromophenyl)-4-cyano-3-methyl-1H-pyrazole
CasNumber:
76982-35-9
MolecularFormula:
C11H9BrN4
MolecularWeight:
277.12
MdlNumber:
MFCD08459269
Smiles:
N#Cc1c(C)nn(c1N)c1ccc(cc1)Br
Complexity:
292
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
2.9
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Smiles: CNc1ccccc1Oc1ccccc1NC
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Smiles:
CNc1ccccc1Oc1ccccc1NC
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Smiles: CCC1(OCCO1)CC=O
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CCC1(OCCO1)CC=O
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Smiles: CCCCc1oc2c(c1C(=O)c1cc(I)c(c(c1)I)OCCCN(C)C)cccc2
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Smiles:
CCCCc1oc2c(c1C(=O)c1cc(I)c(c(c1)I)OCCCN(C)C)cccc2
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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