AV18270
1048018-91-2 | 3-(Difluoromethyl)-1-methyl-1H-pyrazol-5(4H)-one
Manufacturer: A2B Chem
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CatalogNumber
AV18270
ChemicalName
3-(Difluoromethyl)-1-methyl-1H-pyrazol-5(4H)-one
CasNumber
1048018-91-2
MolecularFormula
C5H6F2N2O
MolecularWeight
148.1107
MdlNumber
MFCD17240576
Smiles
FC(C1=NN(C(=O)C1)C)F
Complexity
190
Covalently-bondedUnitCount
1
HeavyAtomCount
10
HydrogenBondAcceptorCount
4
RotatableBondCount
1
Xlogp3
0.6
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CatalogNumber: AV18270
ChemicalName: 3-(Difluoromethyl)-1-methyl-1H-pyrazol-5(4H)-one
CasNumber: 1048018-91-2
MolecularFormula: C5H6F2N2O
MolecularWeight: 148.1107
MdlNumber: MFCD17240576
Smiles: FC(C1=NN(C(=O)C1)C)F
Complexity: 190
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 4
RotatableBondCount: 1
Xlogp3: 0.6
CatalogNumber:
AV18270
ChemicalName:
3-(Difluoromethyl)-1-methyl-1H-pyrazol-5(4H)-one
CasNumber:
1048018-91-2
MolecularFormula:
C5H6F2N2O
MolecularWeight:
148.1107
MdlNumber:
MFCD17240576
Smiles:
FC(C1=NN(C(=O)C1)C)F
Complexity:
190
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
4
RotatableBondCount:
1
Xlogp3:
0.6
CatalogNumber: AV18272
ChemicalName: trans-4-(4-(Cyclopropylmethyl)piperazin-1-yl)cyclohexanamine trihydrochloride
CasNumber: 882660-42-6
MolecularFormula: C14H30Cl3N3
MolecularWeight: 346.7671
MdlNumber: MFCD13185107
Smiles: N[C@@H]1CC[C@H](CC1)N1CCN(CC1)CC1CC1.Cl.Cl.Cl
Complexity: 236
Covalently-bondedUnitCount: 4
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 3
RotatableBondCount: 3
Xlogp3: __
CatalogNumber:
AV18272
ChemicalName:
trans-4-(4-(Cyclopropylmethyl)piperazin-1-yl)cyclohexanamine trihydrochloride
CasNumber:
882660-42-6
MolecularFormula:
C14H30Cl3N3
MolecularWeight:
346.7671
MdlNumber:
MFCD13185107
Smiles:
N[C@@H]1CC[C@H](CC1)N1CCN(CC1)CC1CC1.Cl.Cl.Cl
Complexity:
236
Covalently-bondedUnitCount:
4
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
3
RotatableBondCount:
3
Xlogp3:
__
CatalogNumber: AV18273
ChemicalName: 1-(2,5-Dimethoxyphenyl)-2-(4-fluorophenyl)ethanone
CasNumber: 1097164-22-1
MolecularFormula: C16H15FO3
MolecularWeight: 274.2869
MdlNumber: MFCD13660606
Smiles: COc1ccc(cc1C(=O)Cc1ccc(cc1)F)OC
Complexity: 313
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 4
RotatableBondCount: 5
Xlogp3: 3.2
CatalogNumber:
AV18273
ChemicalName:
1-(2,5-Dimethoxyphenyl)-2-(4-fluorophenyl)ethanone
CasNumber:
1097164-22-1
MolecularFormula:
C16H15FO3
MolecularWeight:
274.2869
MdlNumber:
MFCD13660606
Smiles:
COc1ccc(cc1C(=O)Cc1ccc(cc1)F)OC
Complexity:
313
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
4
RotatableBondCount:
5
Xlogp3:
3.2
CatalogNumber: AV18274
ChemicalName: 2,4,5-Trimethoxyphenol
CasNumber: 20491-91-2
MolecularFormula: C9H12O4
MolecularWeight: 184.1892
MdlNumber: MFCD17015434
Smiles: COc1cc(OC)c(cc1OC)O
Complexity: 151
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
RotatableBondCount: 3
Xlogp3: 1.9
CatalogNumber:
AV18274
ChemicalName:
2,4,5-Trimethoxyphenol
CasNumber:
20491-91-2
MolecularFormula:
C9H12O4
MolecularWeight:
184.1892
MdlNumber:
MFCD17015434
Smiles:
COc1cc(OC)c(cc1OC)O
Complexity:
151
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
RotatableBondCount:
3
Xlogp3:
1.9