AB57969
186650-98-6 | 4-(4-BOC-Piperazino)benzonitrile
Manufacturer: A2B Chem
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CatalogNumber
AB57969
ChemicalName
4-(4-BOC-Piperazino)benzonitrile
CasNumber
186650-98-6
MolecularFormula
C16H21N3O2
MolecularWeight
287.3568
MdlNumber
MFCD03791198
Smiles
N#Cc1ccc(cc1)N1CCN(CC1)C(=O)OC(C)(C)C
Complexity
405
Covalently-bondedUnitCount
1
HeavyAtomCount
21
HydrogenBondAcceptorCount
4
RotatableBondCount
3
Xlogp3
2.4
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CatalogNumber: AB57969
ChemicalName: 4-(4-BOC-Piperazino)benzonitrile
CasNumber: 186650-98-6
MolecularFormula: C16H21N3O2
MolecularWeight: 287.3568
MdlNumber: MFCD03791198
Smiles: N#Cc1ccc(cc1)N1CCN(CC1)C(=O)OC(C)(C)C
Complexity: 405
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 4
RotatableBondCount: 3
Xlogp3: 2.4
CatalogNumber:
AB57969
ChemicalName:
4-(4-BOC-Piperazino)benzonitrile
CasNumber:
186650-98-6
MolecularFormula:
C16H21N3O2
MolecularWeight:
287.3568
MdlNumber:
MFCD03791198
Smiles:
N#Cc1ccc(cc1)N1CCN(CC1)C(=O)OC(C)(C)C
Complexity:
405
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
4
RotatableBondCount:
3
Xlogp3:
2.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OCCC(C1CCN(CC1)C(=O)OC(C)(C)C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OCCC(C1CCN(CC1)C(=O)OC(C)(C)C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Cc1ccc(cc1)N1CCN(CC1)C(=O)OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Cc1ccc(cc1)N1CCN(CC1)C(=O)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB57972
ChemicalName: 4-Chloromethyl-piperidine-1-carboxylic acid tert-butyl ester
CasNumber: 479057-79-9
MolecularFormula: C11H20ClNO2
MolecularWeight: 233.735
MdlNumber: MFCD08689676
Smiles: ClCC1CCN(CC1)C(=O)OC(C)(C)C
Complexity: 217
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 2
RotatableBondCount: 3
Xlogp3: 2.4
CatalogNumber:
AB57972
ChemicalName:
4-Chloromethyl-piperidine-1-carboxylic acid tert-butyl ester
CasNumber:
479057-79-9
MolecularFormula:
C11H20ClNO2
MolecularWeight:
233.735
MdlNumber:
MFCD08689676
Smiles:
ClCC1CCN(CC1)C(=O)OC(C)(C)C
Complexity:
217
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
2
RotatableBondCount:
3
Xlogp3:
2.4