AA84445
162686-53-5 | 1-Benzyl-4-(hydroxymethyl)piperidine-4-carbonitrile
Manufacturer: A2B Chem
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CatalogNumber
AA84445
ChemicalName
1-Benzyl-4-(hydroxymethyl)piperidine-4-carbonitrile
CasNumber
162686-53-5
MolecularFormula
C14H18N2O
MolecularWeight
230.3055
MdlNumber
MFCD12406111
Smiles
OCC1(CCN(CC1)Cc1ccccc1)C#N
Complexity
280
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
1.1
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CatalogNumber: AA84445
ChemicalName: 1-Benzyl-4-(hydroxymethyl)piperidine-4-carbonitrile
CasNumber: 162686-53-5
MolecularFormula: C14H18N2O
MolecularWeight: 230.3055
MdlNumber: MFCD12406111
Smiles: OCC1(CCN(CC1)Cc1ccccc1)C#N
Complexity: 280
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 1.1
CatalogNumber:
AA84445
ChemicalName:
1-Benzyl-4-(hydroxymethyl)piperidine-4-carbonitrile
CasNumber:
162686-53-5
MolecularFormula:
C14H18N2O
MolecularWeight:
230.3055
MdlNumber:
MFCD12406111
Smiles:
OCC1(CCN(CC1)Cc1ccccc1)C#N
Complexity:
280
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
1.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OCC(C(F)(F)F)N
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OCC(C(F)(F)F)N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AA84448
ChemicalName: 4-Chlorothieno[3,2-d]pyrimidine
CasNumber: 16269-66-2
MolecularFormula: C6H3ClN2S
MolecularWeight: 170.6194
MdlNumber: MFCD00122144
Smiles: Clc1ncnc2c1scc2
Complexity: 133
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 1.8
CatalogNumber:
AA84448
ChemicalName:
4-Chlorothieno[3,2-d]pyrimidine
CasNumber:
16269-66-2
MolecularFormula:
C6H3ClN2S
MolecularWeight:
170.6194
MdlNumber:
MFCD00122144
Smiles:
Clc1ncnc2c1scc2
Complexity:
133
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
1.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: ClC1c2cccc3c2c(C1=O)ccc3
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
ClC1c2cccc3c2c(C1=O)ccc3
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__