AH93034
914349-31-8 | 1-Boc-3-bromo-5-nitroindole
Manufacturer: A2B Chem
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CatalogNumber
AH93034
ChemicalName
1-Boc-3-bromo-5-nitroindole
CasNumber
914349-31-8
MolecularFormula
C13H13BrN2O4
MolecularWeight
341.1573199999999
MdlNumber
MFCD05864776
Smiles
[O-][N+](=O)c1ccc2c(c1)c(Br)cn2C(=O)OC(C)(C)C
Complexity
404
Covalently-bondedUnitCount
1
HeavyAtomCount
20
HydrogenBondAcceptorCount
4
RotatableBondCount
2
Xlogp3
3.8
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CatalogNumber: AH93034
ChemicalName: 1-Boc-3-bromo-5-nitroindole
CasNumber: 914349-31-8
MolecularFormula: C13H13BrN2O4
MolecularWeight: 341.1573199999999
MdlNumber: MFCD05864776
Smiles: [O-][N+](=O)c1ccc2c(c1)c(Br)cn2C(=O)OC(C)(C)C
Complexity: 404
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 4
RotatableBondCount: 2
Xlogp3: 3.8
CatalogNumber:
AH93034
ChemicalName:
1-Boc-3-bromo-5-nitroindole
CasNumber:
914349-31-8
MolecularFormula:
C13H13BrN2O4
MolecularWeight:
341.1573199999999
MdlNumber:
MFCD05864776
Smiles:
[O-][N+](=O)c1ccc2c(c1)c(Br)cn2C(=O)OC(C)(C)C
Complexity:
404
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
4
RotatableBondCount:
2
Xlogp3:
3.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=Cc1cn(c2c1cc(cc2)[N+](=O)[O-])C(=O)OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=Cc1cn(c2c1cc(cc2)[N+](=O)[O-])C(=O)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AH93036
ChemicalName: Methyl 1-(5-bromopyrimidin-2-yl)piperidine-4-carboxylate
CasNumber: 914347-01-6
MolecularFormula: C11H14BrN3O2
MolecularWeight: 300.15176
MdlNumber: MFCD08275691
Smiles: COC(=O)C1CCN(CC1)c1ncc(cn1)Br
Complexity: 261
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 5
RotatableBondCount: 3
Xlogp3: 1.7
CatalogNumber:
AH93036
ChemicalName:
Methyl 1-(5-bromopyrimidin-2-yl)piperidine-4-carboxylate
CasNumber:
914347-01-6
MolecularFormula:
C11H14BrN3O2
MolecularWeight:
300.15176
MdlNumber:
MFCD08275691
Smiles:
COC(=O)C1CCN(CC1)c1ncc(cn1)Br
Complexity:
261
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
5
RotatableBondCount:
3
Xlogp3:
1.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Cc1cccc(c1)c1cnc(nc1)N
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Cc1cccc(c1)c1cnc(nc1)N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__