AV18645
1187189-41-8 | Ethyl 6-(4-bromo-3-formylphenoxy)-2-ethoxynicotinate
Manufacturer: A2B Chem
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CatalogNumber
AV18645
ChemicalName
Ethyl 6-(4-bromo-3-formylphenoxy)-2-ethoxynicotinate
CasNumber
1187189-41-8
MolecularFormula
C17H16BrNO5
MolecularWeight
394.2166
MdlNumber
MFCD30185084
Smiles
CCOc1nc(ccc1C(=O)OCC)Oc1ccc(c(c1)C=O)Br
Complexity
422
Covalently-bondedUnitCount
1
HeavyAtomCount
24
HydrogenBondAcceptorCount
6
RotatableBondCount
8
Xlogp3
3.8
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CatalogNumber: AV18645
ChemicalName: Ethyl 6-(4-bromo-3-formylphenoxy)-2-ethoxynicotinate
CasNumber: 1187189-41-8
MolecularFormula: C17H16BrNO5
MolecularWeight: 394.2166
MdlNumber: MFCD30185084
Smiles: CCOc1nc(ccc1C(=O)OCC)Oc1ccc(c(c1)C=O)Br
Complexity: 422
Covalently-bondedUnitCount: 1
HeavyAtomCount: 24
HydrogenBondAcceptorCount: 6
RotatableBondCount: 8
Xlogp3: 3.8
CatalogNumber:
AV18645
ChemicalName:
Ethyl 6-(4-bromo-3-formylphenoxy)-2-ethoxynicotinate
CasNumber:
1187189-41-8
MolecularFormula:
C17H16BrNO5
MolecularWeight:
394.2166
MdlNumber:
MFCD30185084
Smiles:
CCOc1nc(ccc1C(=O)OCC)Oc1ccc(c(c1)C=O)Br
Complexity:
422
Covalently-bondedUnitCount:
1
HeavyAtomCount:
24
HydrogenBondAcceptorCount:
6
RotatableBondCount:
8
Xlogp3:
3.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)[C@H]1[C@@H]2CC[C@H](N1C(=O)OC(C)(C)C)C2.OC(=O)[C@@H]1[C@H]2CC[C@@H](N1C(=O)OC(C)(C)C)C2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
OC(=O)[C@H]1[C@@H]2CC[C@H](N1C(=O)OC(C)(C)C)C2.OC(=O)[C@@H]1[C@H]2CC[C@@H](N1C(=O)OC(C)(C)C)C2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC([Si](OCc1ncccn1)(C)C)(C)C
Complexity: 195
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC([Si](OCc1ncccn1)(C)C)(C)C
Complexity:
195
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AV18648
ChemicalName: 1-Benzyl-4-(2-hydroxyphenyl)piperidin-4-ol
CasNumber: 474396-94-6
MolecularFormula: C18H21NO2
MolecularWeight: 283.3648
MdlNumber: MFCD28952788
Smiles: Oc1ccccc1C1(O)CCN(CC1)Cc1ccccc1
Complexity: 319
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 3
RotatableBondCount: 3
Xlogp3: 2.6
CatalogNumber:
AV18648
ChemicalName:
1-Benzyl-4-(2-hydroxyphenyl)piperidin-4-ol
CasNumber:
474396-94-6
MolecularFormula:
C18H21NO2
MolecularWeight:
283.3648
MdlNumber:
MFCD28952788
Smiles:
Oc1ccccc1C1(O)CCN(CC1)Cc1ccccc1
Complexity:
319
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
3
RotatableBondCount:
3
Xlogp3:
2.6