AA20094
1150164-31-0 | Ethyl 1-(3-chloropyridin-2-yl)-5-methylpyrazole-4-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AA20094
ChemicalName
Ethyl 1-(3-chloropyridin-2-yl)-5-methylpyrazole-4-carboxylate
CasNumber
1150164-31-0
MolecularFormula
C12H12ClN3O2
MolecularWeight
265.6956
MdlNumber
MFCD11855908
Smiles
CCOC(=O)c1cnn(c1C)c1ncccc1Cl
Complexity
303
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
4
RotatableBondCount
4
Xlogp3
2.4
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CatalogNumber: AA20094
ChemicalName: Ethyl 1-(3-chloropyridin-2-yl)-5-methylpyrazole-4-carboxylate
CasNumber: 1150164-31-0
MolecularFormula: C12H12ClN3O2
MolecularWeight: 265.6956
MdlNumber: MFCD11855908
Smiles: CCOC(=O)c1cnn(c1C)c1ncccc1Cl
Complexity: 303
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 4
RotatableBondCount: 4
Xlogp3: 2.4
CatalogNumber:
AA20094
ChemicalName:
Ethyl 1-(3-chloropyridin-2-yl)-5-methylpyrazole-4-carboxylate
CasNumber:
1150164-31-0
MolecularFormula:
C12H12ClN3O2
MolecularWeight:
265.6956
MdlNumber:
MFCD11855908
Smiles:
CCOC(=O)c1cnn(c1C)c1ncccc1Cl
Complexity:
303
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
4
RotatableBondCount:
4
Xlogp3:
2.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)c1cnn(c1C(C)(C)C)c1ccc(cn1)Br
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)c1cnn(c1C(C)(C)C)c1ccc(cn1)Br
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)c1cnn(c1C1CC1)c1ccc(cn1)Br
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)c1cnn(c1C1CC1)c1ccc(cn1)Br
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
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CatalogNumber: AA20097
ChemicalName: 6-(Cyclopropylamino)-5-nitroquinoline
CasNumber: 1150164-23-0
MolecularFormula: C12H11N3O2
MolecularWeight: 229.2346
MdlNumber: MFCD12026014
Smiles: [O-][N+](=O)c1c(ccc2c1cccn2)NC1CC1
Complexity: 301
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 4
RotatableBondCount: 2
Xlogp3: 3.1
CatalogNumber:
AA20097
ChemicalName:
6-(Cyclopropylamino)-5-nitroquinoline
CasNumber:
1150164-23-0
MolecularFormula:
C12H11N3O2
MolecularWeight:
229.2346
MdlNumber:
MFCD12026014
Smiles:
[O-][N+](=O)c1c(ccc2c1cccn2)NC1CC1
Complexity:
301
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
4
RotatableBondCount:
2
Xlogp3:
3.1