AG72903
62718-31-4 | 1-Benzylpiperidine-4-carbonitrile
Manufacturer: A2B Chem
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CatalogNumber
AG72903
ChemicalName
1-Benzylpiperidine-4-carbonitrile
CasNumber
62718-31-4
MolecularFormula
C13H16N2
MolecularWeight
200.2795
MdlNumber
MFCD01540574
Smiles
N#CC1CCN(CC1)Cc1ccccc1
Complexity
226
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
2
RotatableBondCount
2
Xlogp3
2
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CatalogNumber: AG72903
ChemicalName: 1-Benzylpiperidine-4-carbonitrile
CasNumber: 62718-31-4
MolecularFormula: C13H16N2
MolecularWeight: 200.2795
MdlNumber: MFCD01540574
Smiles: N#CC1CCN(CC1)Cc1ccccc1
Complexity: 226
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 2
RotatableBondCount: 2
Xlogp3: 2
CatalogNumber:
AG72903
ChemicalName:
1-Benzylpiperidine-4-carbonitrile
CasNumber:
62718-31-4
MolecularFormula:
C13H16N2
MolecularWeight:
200.2795
MdlNumber:
MFCD01540574
Smiles:
N#CC1CCN(CC1)Cc1ccccc1
Complexity:
226
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
2
RotatableBondCount:
2
Xlogp3:
2
CatalogNumber: __
ChemicalName: __
CasNumber: __
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Smiles: O=C1CC[C@]2(C(=C1)[C@@H](O)C[C@@H]1[C@@H]2CC[C@]2([C@H]1CC[C@@H]2C(=O)C)C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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MolecularFormula:
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MolecularWeight:
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Smiles:
O=C1CC[C@]2(C(=C1)[C@@H](O)C[C@@H]1[C@@H]2CC[C@]2([C@H]1CC[C@@H]2C(=O)C)C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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MolecularFormula: __
MolecularWeight: __
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Smiles: COC(=O)[C@@H]1CN(Cc2ccccc2)C(=O)C[C@H]1c1ccc(cc1)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
COC(=O)[C@@H]1CN(Cc2ccccc2)C(=O)C[C@H]1c1ccc(cc1)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C1[C@@H](N)[C@@H]2N1C(=C(CS2)CSc1n[nH]nn1)C(=O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C1[C@@H](N)[C@@H]2N1C(=C(CS2)CSc1n[nH]nn1)C(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__