AI54262
639784-65-9 | (1-Methyl-3-(4-(trifluoromethyl)phenyl)-1h-pyrazol-5-yl)methanol
Manufacturer: A2B Chem
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CatalogNumber
AI54262
ChemicalName
(1-Methyl-3-(4-(trifluoromethyl)phenyl)-1h-pyrazol-5-yl)methanol
CasNumber
639784-65-9
MolecularFormula
C12H11F3N2O
MolecularWeight
256.2237
MdlNumber
MFCD17926173
Smiles
OCc1cc(nn1C)c1ccc(cc1)C(F)(F)F
Complexity
277
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
1.9
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CatalogNumber: AI54262
ChemicalName: (1-Methyl-3-(4-(trifluoromethyl)phenyl)-1h-pyrazol-5-yl)methanol
CasNumber: 639784-65-9
MolecularFormula: C12H11F3N2O
MolecularWeight: 256.2237
MdlNumber: MFCD17926173
Smiles: OCc1cc(nn1C)c1ccc(cc1)C(F)(F)F
Complexity: 277
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 1.9
CatalogNumber:
AI54262
ChemicalName:
(1-Methyl-3-(4-(trifluoromethyl)phenyl)-1h-pyrazol-5-yl)methanol
CasNumber:
639784-65-9
MolecularFormula:
C12H11F3N2O
MolecularWeight:
256.2237
MdlNumber:
MFCD17926173
Smiles:
OCc1cc(nn1C)c1ccc(cc1)C(F)(F)F
Complexity:
277
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
1.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: NCCCCC(=O)OC
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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CasNumber:
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MolecularFormula:
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Smiles:
NCCCCC(=O)OC
Complexity:
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HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
__
CatalogNumber: __
ChemicalName: __
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MolecularFormula: __
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MdlNumber: __
Smiles: CNCc1ccccc1O.Cl
Complexity: __
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Smiles:
CNCc1ccccc1O.Cl
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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CatalogNumber: AI54265
ChemicalName: Chlortetracycline hydrochloride
CasNumber: 64-72-2
MolecularFormula: C22H24Cl2N2O8
MolecularWeight: 515.34056
MdlNumber: MFCD00082440
Smiles: CN([C@@H]1C(=C(C(=O)N)C(=O)[C@@]2([C@H]1C[C@H]1C(=C2O)C(=O)c2c([C@@]1(C)O)c(Cl)ccc2O)O)O)C.Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
AI54265
ChemicalName:
Chlortetracycline hydrochloride
CasNumber:
64-72-2
MolecularFormula:
C22H24Cl2N2O8
MolecularWeight:
515.34056
MdlNumber:
MFCD00082440
Smiles:
CN([C@@H]1C(=C(C(=O)N)C(=O)[C@@]2([C@H]1C[C@H]1C(=C2O)C(=O)c2c([C@@]1(C)O)c(Cl)ccc2O)O)O)C.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__