AA45046
1291487-19-8 | 1-BOC-4-(2-(4-bromophenyl)-2-oxoethyl)piperazine
Manufacturer: A2B Chem
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CatalogNumber
AA45046
ChemicalName
1-BOC-4-(2-(4-bromophenyl)-2-oxoethyl)piperazine
CasNumber
1291487-19-8
MolecularFormula
C17H23BrN2O3
MolecularWeight
383.2801
MdlNumber
MFCD18837615
Smiles
O=C(c1ccc(cc1)Br)CN1CCN(CC1)C(=O)OC(C)(C)C
Complexity
420
Covalently-bondedUnitCount
1
HeavyAtomCount
23
HydrogenBondAcceptorCount
4
RotatableBondCount
5
Xlogp3
3
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CatalogNumber: AA45046
ChemicalName: 1-BOC-4-(2-(4-bromophenyl)-2-oxoethyl)piperazine
CasNumber: 1291487-19-8
MolecularFormula: C17H23BrN2O3
MolecularWeight: 383.2801
MdlNumber: MFCD18837615
Smiles: O=C(c1ccc(cc1)Br)CN1CCN(CC1)C(=O)OC(C)(C)C
Complexity: 420
Covalently-bondedUnitCount: 1
HeavyAtomCount: 23
HydrogenBondAcceptorCount: 4
RotatableBondCount: 5
Xlogp3: 3
CatalogNumber:
AA45046
ChemicalName:
1-BOC-4-(2-(4-bromophenyl)-2-oxoethyl)piperazine
CasNumber:
1291487-19-8
MolecularFormula:
C17H23BrN2O3
MolecularWeight:
383.2801
MdlNumber:
MFCD18837615
Smiles:
O=C(c1ccc(cc1)Br)CN1CCN(CC1)C(=O)OC(C)(C)C
Complexity:
420
Covalently-bondedUnitCount:
1
HeavyAtomCount:
23
HydrogenBondAcceptorCount:
4
RotatableBondCount:
5
Xlogp3:
3
CatalogNumber: AA45047
ChemicalName: 4-Bromo-2-(2-methoxyethoxy)toluene
CasNumber: 1291487-18-7
MolecularFormula: C10H13BrO2
MolecularWeight: 245.113
MdlNumber: MFCD18837614
Smiles: Cc1ccc(cc1OCCOC)Br
Complexity: 141
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 2
RotatableBondCount: 4
Xlogp3: 2.8
CatalogNumber:
AA45047
ChemicalName:
4-Bromo-2-(2-methoxyethoxy)toluene
CasNumber:
1291487-18-7
MolecularFormula:
C10H13BrO2
MolecularWeight:
245.113
MdlNumber:
MFCD18837614
Smiles:
Cc1ccc(cc1OCCOC)Br
Complexity:
141
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
2
RotatableBondCount:
4
Xlogp3:
2.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC[C@@H](NC(C)C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC[C@@H](NC(C)C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AA45055
ChemicalName: tert-Butyl 3-hydroxyphenethylcarbamate
CasNumber: 129150-68-1
MolecularFormula: C13H19NO3
MolecularWeight: 237.2949
MdlNumber: MFCD07376773
Smiles: O=C(OC(C)(C)C)NCCc1cccc(c1)O
Complexity: 248
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 3
RotatableBondCount: 5
Xlogp3: 2.5
CatalogNumber:
AA45055
ChemicalName:
tert-Butyl 3-hydroxyphenethylcarbamate
CasNumber:
129150-68-1
MolecularFormula:
C13H19NO3
MolecularWeight:
237.2949
MdlNumber:
MFCD07376773
Smiles:
O=C(OC(C)(C)C)NCCc1cccc(c1)O
Complexity:
248
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
3
RotatableBondCount:
5
Xlogp3:
2.5