AB58561
53617-36-0 | 1-Methyl-4-(piperidin-4-yl)piperazine
Manufacturer: A2B Chem
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CatalogNumber
AB58561
ChemicalName
1-Methyl-4-(piperidin-4-yl)piperazine
CasNumber
53617-36-0
MolecularFormula
C10H21N3
MolecularWeight
183.2938
MdlNumber
MFCD03274729
Smiles
CN1CCN(CC1)C1CCNCC1
Complexity
146
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
0.2
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CatalogNumber: AB58561
ChemicalName: 1-Methyl-4-(piperidin-4-yl)piperazine
CasNumber: 53617-36-0
MolecularFormula: C10H21N3
MolecularWeight: 183.2938
MdlNumber: MFCD03274729
Smiles: CN1CCN(CC1)C1CCNCC1
Complexity: 146
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 0.2
CatalogNumber:
AB58561
ChemicalName:
1-Methyl-4-(piperidin-4-yl)piperazine
CasNumber:
53617-36-0
MolecularFormula:
C10H21N3
MolecularWeight:
183.2938
MdlNumber:
MFCD03274729
Smiles:
CN1CCN(CC1)C1CCNCC1
Complexity:
146
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
0.2
CatalogNumber: AB58562
ChemicalName: 4-(4-Methylpiperazin-1-yl)phenylboronic acid, pinacol ester
CasNumber: 747413-21-4
MolecularFormula: C17H27BN2O2
MolecularWeight: 302.2195
MdlNumber: MFCD06795650
Smiles: CN1CCN(CC1)c1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Complexity: 370
Covalently-bondedUnitCount: 1
HeavyAtomCount: 22
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: __
RotatableBondCount: 2
Xlogp3: __
CatalogNumber:
AB58562
ChemicalName:
4-(4-Methylpiperazin-1-yl)phenylboronic acid, pinacol ester
CasNumber:
747413-21-4
MolecularFormula:
C17H27BN2O2
MolecularWeight:
302.2195
MdlNumber:
MFCD06795650
Smiles:
CN1CCN(CC1)c1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Complexity:
370
Covalently-bondedUnitCount:
1
HeavyAtomCount:
22
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
__
RotatableBondCount:
2
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: N#CC1(CCN(CC1)C)c1cccc(c1)OC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
N#CC1(CCN(CC1)C)c1cccc(c1)OC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB58564
ChemicalName: 4-Nitro-1-methylbenzimidazole
CasNumber: 31493-66-0
MolecularFormula: C8H7N3O2
MolecularWeight: 177.1601
MdlNumber: MFCD02181146
Smiles: [O-][N+](=O)c1cccc2c1ncn2C
Complexity: 216
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 1.3
CatalogNumber:
AB58564
ChemicalName:
4-Nitro-1-methylbenzimidazole
CasNumber:
31493-66-0
MolecularFormula:
C8H7N3O2
MolecularWeight:
177.1601
MdlNumber:
MFCD02181146
Smiles:
[O-][N+](=O)c1cccc2c1ncn2C
Complexity:
216
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
1.3