AE20257
1072944-89-8 | 5-Amino-1-(3-bromophenyl)-4-cyano-3-methylpyrazole
Manufacturer: A2B Chem
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CatalogNumber
AE20257
ChemicalName
5-Amino-1-(3-bromophenyl)-4-cyano-3-methylpyrazole
CasNumber
1072944-89-8
MolecularFormula
C11H9BrN4
MolecularWeight
277.12
MdlNumber
MFCD11504941
Smiles
N#Cc1c(C)nn(c1N)c1cccc(c1)Br
Complexity
300
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
2.9
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CatalogNumber: AE20257
ChemicalName: 5-Amino-1-(3-bromophenyl)-4-cyano-3-methylpyrazole
CasNumber: 1072944-89-8
MolecularFormula: C11H9BrN4
MolecularWeight: 277.12
MdlNumber: MFCD11504941
Smiles: N#Cc1c(C)nn(c1N)c1cccc(c1)Br
Complexity: 300
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 2.9
CatalogNumber:
AE20257
ChemicalName:
5-Amino-1-(3-bromophenyl)-4-cyano-3-methylpyrazole
CasNumber:
1072944-89-8
MolecularFormula:
C11H9BrN4
MolecularWeight:
277.12
MdlNumber:
MFCD11504941
Smiles:
N#Cc1c(C)nn(c1N)c1cccc(c1)Br
Complexity:
300
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
2.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Fc1cncc(c1)CNCc1cncc(c1)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
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:
Fc1cncc(c1)CNCc1cncc(c1)F
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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CatalogNumber: AE20259
ChemicalName: Methyl 6-acetamido-4-chloroquinoline-2-carboxylate
CasNumber: 1133115-95-3
MolecularFormula: C13H11ClN2O3
MolecularWeight: 278.691
MdlNumber: MFCD11855917
Smiles: COC(=O)c1cc(Cl)c2c(n1)ccc(c2)NC(=O)C
Complexity: 364
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 2.2
CatalogNumber:
AE20259
ChemicalName:
Methyl 6-acetamido-4-chloroquinoline-2-carboxylate
CasNumber:
1133115-95-3
MolecularFormula:
C13H11ClN2O3
MolecularWeight:
278.691
MdlNumber:
MFCD11855917
Smiles:
COC(=O)c1cc(Cl)c2c(n1)ccc(c2)NC(=O)C
Complexity:
364
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
2.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Brc1cccc(c1)OC1CCNCC1.Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Brc1cccc(c1)OC1CCNCC1.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__