AB51771
873054-44-5 | N-(2,4-di-tert-butyl-5-hydroxyphenyl)-4-oxo-1,4-dihydroquinoline-3-carboxamide
Manufacturer: A2B Chem
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CatalogNumber
AB51771
ChemicalName
N-(2,4-di-tert-butyl-5-hydroxyphenyl)-4-oxo-1,4-dihydroquinoline-3-carboxamide
CasNumber
873054-44-5
MolecularFormula
C24H28N2O3
MolecularWeight
392.4907
MdlNumber
MFCD17171361
Smiles
O=C(c1c[nH]c2c(c1=O)cccc2)Nc1cc(O)c(cc1C(C)(C)C)C(C)(C)C
Complexity
671
Covalently-bondedUnitCount
1
HeavyAtomCount
29
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
3
RotatableBondCount
4
Xlogp3
5.6
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CatalogNumber: AB51771
ChemicalName: N-(2,4-di-tert-butyl-5-hydroxyphenyl)-4-oxo-1,4-dihydroquinoline-3-carboxamide
CasNumber: 873054-44-5
MolecularFormula: C24H28N2O3
MolecularWeight: 392.4907
MdlNumber: MFCD17171361
Smiles: O=C(c1c[nH]c2c(c1=O)cccc2)Nc1cc(O)c(cc1C(C)(C)C)C(C)(C)C
Complexity: 671
Covalently-bondedUnitCount: 1
HeavyAtomCount: 29
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 3
RotatableBondCount: 4
Xlogp3: 5.6
CatalogNumber:
AB51771
ChemicalName:
N-(2,4-di-tert-butyl-5-hydroxyphenyl)-4-oxo-1,4-dihydroquinoline-3-carboxamide
CasNumber:
873054-44-5
MolecularFormula:
C24H28N2O3
MolecularWeight:
392.4907
MdlNumber:
MFCD17171361
Smiles:
O=C(c1c[nH]c2c(c1=O)cccc2)Nc1cc(O)c(cc1C(C)(C)C)C(C)(C)C
Complexity:
671
Covalently-bondedUnitCount:
1
HeavyAtomCount:
29
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
3
RotatableBondCount:
4
Xlogp3:
5.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC[C@@H]1O[C@H](O)[C@H]([C@@H]([C@@H]1O[C@@H]1O[C@@H](CO)[C@@H]([C@H]([C@@H]1O)O)O)O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC[C@@H]1O[C@H](O)[C@H]([C@@H]([C@@H]1O[C@@H]1O[C@@H](CO)[C@@H]([C@H]([C@@H]1O)O)O)O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB51773
ChemicalName: Ethyl 2-(2,4,6-trichloropyrimidin-5-yl)acetate
CasNumber: 889944-72-3
MolecularFormula: C8H7Cl3N2O2
MolecularWeight: 269.5124
MdlNumber: MFCD07776806
Smiles: CCOC(=O)Cc1c(Cl)nc(nc1Cl)Cl
Complexity: 218
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: __
RotatableBondCount: 4
Xlogp3: 3.2
CatalogNumber:
AB51773
ChemicalName:
Ethyl 2-(2,4,6-trichloropyrimidin-5-yl)acetate
CasNumber:
889944-72-3
MolecularFormula:
C8H7Cl3N2O2
MolecularWeight:
269.5124
MdlNumber:
MFCD07776806
Smiles:
CCOC(=O)Cc1c(Cl)nc(nc1Cl)Cl
Complexity:
218
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
__
RotatableBondCount:
4
Xlogp3:
3.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)c1ccc(c(c1C)C)Br
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)c1ccc(c(c1C)C)Br
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__