AA83541
1620-55-9 | 1-Phenyl-2-(pyridin-4-yl)ethanone
Manufacturer: A2B Chem
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CatalogNumber
AA83541
ChemicalName
1-Phenyl-2-(pyridin-4-yl)ethanone
CasNumber
1620-55-9
MolecularFormula
C13H11NO
MolecularWeight
197.2325
MdlNumber
MFCD00234969
Smiles
O=C(c1ccccc1)Cc1ccncc1
NscNumber
146504
Complexity
203
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
2
RotatableBondCount
3
Xlogp3
2.1
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CatalogNumber: AA83541
ChemicalName: 1-Phenyl-2-(pyridin-4-yl)ethanone
CasNumber: 1620-55-9
MolecularFormula: C13H11NO
MolecularWeight: 197.2325
MdlNumber: MFCD00234969
Smiles: O=C(c1ccccc1)Cc1ccncc1
NscNumber: 146504
Complexity: 203
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 2
RotatableBondCount: 3
Xlogp3: 2.1
CatalogNumber:
AA83541
ChemicalName:
1-Phenyl-2-(pyridin-4-yl)ethanone
CasNumber:
1620-55-9
MolecularFormula:
C13H11NO
MolecularWeight:
197.2325
MdlNumber:
MFCD00234969
Smiles:
O=C(c1ccccc1)Cc1ccncc1
NscNumber:
146504
Complexity:
203
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
2
RotatableBondCount:
3
Xlogp3:
2.1
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Smiles: O=C(c1ccccc1)Cc1ccccn1
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Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
O=C(c1ccccc1)Cc1ccccn1
NscNumber:
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Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
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Smiles: SCc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C
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Smiles:
SCc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C
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Complexity:
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Covalently-bondedUnitCount:
__
HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
__
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Smiles: OC(c1ccncc1)(c1ccccc1)c1ccccc1
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(c1ccncc1)(c1ccccc1)c1ccccc1
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__