AE20285
1133115-74-8 | 1-BOC-4-(5-nitroquinolin-8-yl)piperazine
Manufacturer: A2B Chem
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CatalogNumber
AE20285
ChemicalName
1-BOC-4-(5-nitroquinolin-8-yl)piperazine
CasNumber
1133115-74-8
MolecularFormula
C18H22N4O4
MolecularWeight
358.3917
MdlNumber
MFCD11855892
Smiles
O=C(N1CCN(CC1)c1ccc(c2c1nccc2)[N+](=O)[O-])OC(C)(C)C
Complexity
522
Covalently-bondedUnitCount
1
HeavyAtomCount
26
HydrogenBondAcceptorCount
6
RotatableBondCount
3
Xlogp3
2.8
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CatalogNumber: AE20285
ChemicalName: 1-BOC-4-(5-nitroquinolin-8-yl)piperazine
CasNumber: 1133115-74-8
MolecularFormula: C18H22N4O4
MolecularWeight: 358.3917
MdlNumber: MFCD11855892
Smiles: O=C(N1CCN(CC1)c1ccc(c2c1nccc2)[N+](=O)[O-])OC(C)(C)C
Complexity: 522
Covalently-bondedUnitCount: 1
HeavyAtomCount: 26
HydrogenBondAcceptorCount: 6
RotatableBondCount: 3
Xlogp3: 2.8
CatalogNumber:
AE20285
ChemicalName:
1-BOC-4-(5-nitroquinolin-8-yl)piperazine
CasNumber:
1133115-74-8
MolecularFormula:
C18H22N4O4
MolecularWeight:
358.3917
MdlNumber:
MFCD11855892
Smiles:
O=C(N1CCN(CC1)c1ccc(c2c1nccc2)[N+](=O)[O-])OC(C)(C)C
Complexity:
522
Covalently-bondedUnitCount:
1
HeavyAtomCount:
26
HydrogenBondAcceptorCount:
6
RotatableBondCount:
3
Xlogp3:
2.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCc1ccc(cc1)c1cccc(c1)C(=O)O
Complexity: 254
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 4.4
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCc1ccc(cc1)c1cccc(c1)C(=O)O
Complexity:
254
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
4.4
CatalogNumber: AE20287
ChemicalName: 5-Bromo-2-piperazinopyridine, HCl
CasNumber: 1187386-40-8
MolecularFormula: C9H13BrClN3
MolecularWeight: 278.5766
MdlNumber: MFCD12913994
Smiles: Brc1ccc(nc1)N1CCNCC1.Cl
Complexity: 159
Covalently-bondedUnitCount: 2
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
RotatableBondCount: 1
Xlogp3: __
CatalogNumber:
AE20287
ChemicalName:
5-Bromo-2-piperazinopyridine, HCl
CasNumber:
1187386-40-8
MolecularFormula:
C9H13BrClN3
MolecularWeight:
278.5766
MdlNumber:
MFCD12913994
Smiles:
Brc1ccc(nc1)N1CCNCC1.Cl
Complexity:
159
Covalently-bondedUnitCount:
2
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
RotatableBondCount:
1
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)c1ccc(s1)c1cccc(c1)C(F)(F)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)c1ccc(s1)c1cccc(c1)C(F)(F)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__