AB35448
288251-64-9 | Ethyl 1-(4-fluorophenyl)-3-methyl-1H-pyrazole-5-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AB35448
ChemicalName
Ethyl 1-(4-fluorophenyl)-3-methyl-1H-pyrazole-5-carboxylate
CasNumber
288251-64-9
MolecularFormula
C13H13FN2O2
MolecularWeight
248.2529
MdlNumber
MFCD06408993
Smiles
CCOC(=O)c1cc(nn1c1ccc(cc1)F)C
Complexity
293
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
4
RotatableBondCount
4
Xlogp3
2.9
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CatalogNumber: AB35448
ChemicalName: Ethyl 1-(4-fluorophenyl)-3-methyl-1H-pyrazole-5-carboxylate
CasNumber: 288251-64-9
MolecularFormula: C13H13FN2O2
MolecularWeight: 248.2529
MdlNumber: MFCD06408993
Smiles: CCOC(=O)c1cc(nn1c1ccc(cc1)F)C
Complexity: 293
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 4
RotatableBondCount: 4
Xlogp3: 2.9
CatalogNumber:
AB35448
ChemicalName:
Ethyl 1-(4-fluorophenyl)-3-methyl-1H-pyrazole-5-carboxylate
CasNumber:
288251-64-9
MolecularFormula:
C13H13FN2O2
MolecularWeight:
248.2529
MdlNumber:
MFCD06408993
Smiles:
CCOC(=O)c1cc(nn1c1ccc(cc1)F)C
Complexity:
293
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
4
RotatableBondCount:
4
Xlogp3:
2.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)c1cnn(c1)CC(F)(F)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
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MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)c1cnn(c1)CC(F)(F)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)c1cnn(c1C)C(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
OC(=O)c1cnn(c1C)C(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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CatalogNumber: AB35451
ChemicalName: 1-(4-chlorophenyl)-N-{3-cyano-4-[4-(morpholin-4-yl)piperidin-1-yl]phenyl}-5-methylpyrazole-4-carboxamide
CasNumber: 288250-47-5
MolecularFormula: C27H29ClN6O2
MolecularWeight: 505.0112
MdlNumber: MFCD28099803
Smiles: N#Cc1cc(ccc1N1CCC(CC1)N1CCOCC1)NC(=O)c1cnn(c1C)c1ccc(cc1)Cl
Complexity: 784
Covalently-bondedUnitCount: 1
HeavyAtomCount: 36
HydrogenBondAcceptorCount: 6
RotatableBondCount: 5
Xlogp3: 3.8
CatalogNumber:
AB35451
ChemicalName:
1-(4-chlorophenyl)-N-{3-cyano-4-[4-(morpholin-4-yl)piperidin-1-yl]phenyl}-5-methylpyrazole-4-carboxamide
CasNumber:
288250-47-5
MolecularFormula:
C27H29ClN6O2
MolecularWeight:
505.0112
MdlNumber:
MFCD28099803
Smiles:
N#Cc1cc(ccc1N1CCC(CC1)N1CCOCC1)NC(=O)c1cnn(c1C)c1ccc(cc1)Cl
Complexity:
784
Covalently-bondedUnitCount:
1
HeavyAtomCount:
36
HydrogenBondAcceptorCount:
6
RotatableBondCount:
5
Xlogp3:
3.8