AH86317
936-16-3 | 2,3-Dihydro-1,1-dioxo-1,2-benzisothiazole
Manufacturer: A2B Chem
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CatalogNumber
AH86317
ChemicalName
2,3-Dihydro-1,1-dioxo-1,2-benzisothiazole
CasNumber
936-16-3
MolecularFormula
C7H7NO2S
MolecularWeight
169.201
MdlNumber
MFCD03426201
Smiles
O=S1(=O)NCc2c1cccc2
NscNumber
362815
Complexity
242
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
UndefinedAtomStereocenterCount
1
Xlogp3
0.5
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CatalogNumber: AH86317
ChemicalName: 2,3-Dihydro-1,1-dioxo-1,2-benzisothiazole
CasNumber: 936-16-3
MolecularFormula: C7H7NO2S
MolecularWeight: 169.201
MdlNumber: MFCD03426201
Smiles: O=S1(=O)NCc2c1cccc2
NscNumber: 362815
Complexity: 242
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
UndefinedAtomStereocenterCount: 1
Xlogp3: 0.5
CatalogNumber:
AH86317
ChemicalName:
2,3-Dihydro-1,1-dioxo-1,2-benzisothiazole
CasNumber:
936-16-3
MolecularFormula:
C7H7NO2S
MolecularWeight:
169.201
MdlNumber:
MFCD03426201
Smiles:
O=S1(=O)NCc2c1cccc2
NscNumber:
362815
Complexity:
242
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
UndefinedAtomStereocenterCount:
1
Xlogp3:
0.5
CatalogNumber: __
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Smiles: NCCC1CCCNC1.Cl.Cl
NscNumber: __
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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UndefinedAtomStereocenterCount: __
Xlogp3: __
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__
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Smiles:
NCCC1CCCNC1.Cl.Cl
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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UndefinedAtomStereocenterCount:
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__
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Smiles: Ic1ccc(cc1)S(=O)(=O)N[C@@H]1CCN(C1)Cc1ccccc1
NscNumber: __
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MolecularFormula:
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Smiles:
Ic1ccc(cc1)S(=O)(=O)N[C@@H]1CCN(C1)Cc1ccccc1
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Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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UndefinedAtomStereocenterCount:
__
Xlogp3:
__
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MolecularFormula: __
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Smiles: NCc1cc(no1)Br.Cl
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Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
NCc1cc(no1)Br.Cl
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__