AI36314
1457483-77-0 | 2-[(2-Chloropyridin-4-yl)methyl]isoindole-1,3-dione
Manufacturer: A2B Chem
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CatalogNumber
AI36314
ChemicalName
2-[(2-Chloropyridin-4-yl)methyl]isoindole-1,3-dione
CasNumber
1457483-77-0
MolecularFormula
C14H9ClN2O2
MolecularWeight
272.6865
MdlNumber
MFCD17477184
Smiles
Clc1nccc(c1)CN1C(=O)c2c(C1=O)cccc2
Complexity
364
Covalently-bondedUnitCount
1
HeavyAtomCount
19
HydrogenBondAcceptorCount
3
RotatableBondCount
2
Xlogp3
2.3
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CatalogNumber: AI36314
ChemicalName: 2-[(2-Chloropyridin-4-yl)methyl]isoindole-1,3-dione
CasNumber: 1457483-77-0
MolecularFormula: C14H9ClN2O2
MolecularWeight: 272.6865
MdlNumber: MFCD17477184
Smiles: Clc1nccc(c1)CN1C(=O)c2c(C1=O)cccc2
Complexity: 364
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 3
RotatableBondCount: 2
Xlogp3: 2.3
CatalogNumber:
AI36314
ChemicalName:
2-[(2-Chloropyridin-4-yl)methyl]isoindole-1,3-dione
CasNumber:
1457483-77-0
MolecularFormula:
C14H9ClN2O2
MolecularWeight:
272.6865
MdlNumber:
MFCD17477184
Smiles:
Clc1nccc(c1)CN1C(=O)c2c(C1=O)cccc2
Complexity:
364
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
3
RotatableBondCount:
2
Xlogp3:
2.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Brc1ccc(c(c1)F)OCC(F)(F)F
Complexity: 185
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 3.8
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__
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
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Smiles:
Brc1ccc(c(c1)F)OCC(F)(F)F
Complexity:
185
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
3.8
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MolecularFormula: __
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Smiles: O=Cc1ccc(cc1)N(c1cccc(c1)C)C
Complexity: __
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HydrogenBondAcceptorCount: __
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Xlogp3: __
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MolecularFormula:
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Smiles:
O=Cc1ccc(cc1)N(c1cccc(c1)C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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Smiles: CN(/C=C/C(=O)c1cccc2c1cccc2)C
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CN(/C=C/C(=O)c1cccc2c1cccc2)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__