AG19744
5346-56-5 | 5-Amino-4-cyano-3-methyl-1-phenyl-1H-pyrazole
Manufacturer: A2B Chem
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CatalogNumber
AG19744
ChemicalName
5-Amino-4-cyano-3-methyl-1-phenyl-1H-pyrazole
CasNumber
5346-56-5
MolecularFormula
C11H10N4
MolecularWeight
198.2239
MdlNumber
MFCD00128285
Smiles
N#Cc1c(C)nn(c1N)c1ccccc1
Complexity
263
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
2.2
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CatalogNumber: AG19744
ChemicalName: 5-Amino-4-cyano-3-methyl-1-phenyl-1H-pyrazole
CasNumber: 5346-56-5
MolecularFormula: C11H10N4
MolecularWeight: 198.2239
MdlNumber: MFCD00128285
Smiles: N#Cc1c(C)nn(c1N)c1ccccc1
Complexity: 263
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 2.2
CatalogNumber:
AG19744
ChemicalName:
5-Amino-4-cyano-3-methyl-1-phenyl-1H-pyrazole
CasNumber:
5346-56-5
MolecularFormula:
C11H10N4
MolecularWeight:
198.2239
MdlNumber:
MFCD00128285
Smiles:
N#Cc1c(C)nn(c1N)c1ccccc1
Complexity:
263
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
2.2
CatalogNumber: AG19745
ChemicalName: 3-Amino-4-cyano-5-methylpyrazole
CasNumber: 5453-07-6
MolecularFormula: C5H6N4
MolecularWeight: 122.1279
MdlNumber: MFCD02020550
Smiles: N#Cc1c(C)[nH][nH]c1=N
Complexity: 146
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: __
Xlogp3: 0.5
CatalogNumber:
AG19745
ChemicalName:
3-Amino-4-cyano-5-methylpyrazole
CasNumber:
5453-07-6
MolecularFormula:
C5H6N4
MolecularWeight:
122.1279
MdlNumber:
MFCD02020550
Smiles:
N#Cc1c(C)[nH][nH]c1=N
Complexity:
146
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
__
Xlogp3:
0.5
CatalogNumber: AG19746
ChemicalName: 1-BOC-7-methylindole
CasNumber: 442910-62-5
MolecularFormula: C14H17NO2
MolecularWeight: 231.2903
MdlNumber: MFCD09878411
Smiles: Cc1cccc2c1n(cc2)C(=O)OC(C)(C)C
Complexity: 295
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: __
RotatableBondCount: 2
Xlogp3: 3.6
CatalogNumber:
AG19746
ChemicalName:
1-BOC-7-methylindole
CasNumber:
442910-62-5
MolecularFormula:
C14H17NO2
MolecularWeight:
231.2903
MdlNumber:
MFCD09878411
Smiles:
Cc1cccc2c1n(cc2)C(=O)OC(C)(C)C
Complexity:
295
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
__
RotatableBondCount:
2
Xlogp3:
3.6
CatalogNumber: AG19747
ChemicalName: Ethyl 7-chloro-4-hydroxy-8-methylquinoline-3-carboxylate
CasNumber: 5350-94-7
MolecularFormula: C13H12ClNO3
MolecularWeight: 265.6923
MdlNumber: MFCD00173377
Smiles: Cc1c(Cl)ccc2c1ncc(c2O)C(=O)OCC
Complexity: 394
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 3
CatalogNumber:
AG19747
ChemicalName:
Ethyl 7-chloro-4-hydroxy-8-methylquinoline-3-carboxylate
CasNumber:
5350-94-7
MolecularFormula:
C13H12ClNO3
MolecularWeight:
265.6923
MdlNumber:
MFCD00173377
Smiles:
Cc1c(Cl)ccc2c1ncc(c2O)C(=O)OCC
Complexity:
394
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
3