AA31769
1257665-16-9 | 1-(N-Boc-Piperidin-4-ylmethoxy)-3,5-dibromobenzene
Manufacturer: A2B Chem
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CatalogNumber
AA31769
ChemicalName
1-(N-Boc-Piperidin-4-ylmethoxy)-3,5-dibromobenzene
CasNumber
1257665-16-9
MolecularFormula
C17H23Br2NO3
MolecularWeight
449.1774
MdlNumber
MFCD18087722
Smiles
O=C(N1CCC(CC1)COc1cc(Br)cc(c1)Br)OC(C)(C)C
Complexity
382
Covalently-bondedUnitCount
1
HeavyAtomCount
23
HydrogenBondAcceptorCount
3
RotatableBondCount
5
Xlogp3
4.9
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CatalogNumber: AA31769
ChemicalName: 1-(N-Boc-Piperidin-4-ylmethoxy)-3,5-dibromobenzene
CasNumber: 1257665-16-9
MolecularFormula: C17H23Br2NO3
MolecularWeight: 449.1774
MdlNumber: MFCD18087722
Smiles: O=C(N1CCC(CC1)COc1cc(Br)cc(c1)Br)OC(C)(C)C
Complexity: 382
Covalently-bondedUnitCount: 1
HeavyAtomCount: 23
HydrogenBondAcceptorCount: 3
RotatableBondCount: 5
Xlogp3: 4.9
CatalogNumber:
AA31769
ChemicalName:
1-(N-Boc-Piperidin-4-ylmethoxy)-3,5-dibromobenzene
CasNumber:
1257665-16-9
MolecularFormula:
C17H23Br2NO3
MolecularWeight:
449.1774
MdlNumber:
MFCD18087722
Smiles:
O=C(N1CCC(CC1)COc1cc(Br)cc(c1)Br)OC(C)(C)C
Complexity:
382
Covalently-bondedUnitCount:
1
HeavyAtomCount:
23
HydrogenBondAcceptorCount:
3
RotatableBondCount:
5
Xlogp3:
4.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Brc1ccc(c(c1)Br)OCC1CCCCO1
Complexity: 213
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 4
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Brc1ccc(c(c1)Br)OCC1CCCCO1
Complexity:
213
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
4
CatalogNumber: AA31771
ChemicalName: N-t-butyl 4-bromo-2-methoxybenzamide
CasNumber: 1257665-14-7
MolecularFormula: C12H16BrNO2
MolecularWeight: 286.16493999999994
MdlNumber: MFCD18087701
Smiles: COc1cc(Br)ccc1C(=O)NC(C)(C)C
Complexity: 250
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 2
RotatableBondCount: 3
Xlogp3: 3.4
CatalogNumber:
AA31771
ChemicalName:
N-t-butyl 4-bromo-2-methoxybenzamide
CasNumber:
1257665-14-7
MolecularFormula:
C12H16BrNO2
MolecularWeight:
286.16493999999994
MdlNumber:
MFCD18087701
Smiles:
COc1cc(Br)ccc1C(=O)NC(C)(C)C
Complexity:
250
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
2
RotatableBondCount:
3
Xlogp3:
3.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1cc(Br)ccc1C(=O)NC1CC1
Complexity: 243
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 3
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1cc(Br)ccc1C(=O)NC1CC1
Complexity:
243
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
3