AI40431
1820641-75-5 | N-Isopropyl-N-(3-nitrophenyl)methanesulfonamide
Manufacturer: A2B Chem
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CatalogNumber
AI40431
ChemicalName
N-Isopropyl-N-(3-nitrophenyl)methanesulfonamide
CasNumber
1820641-75-5
MolecularFormula
C10H14N2O4S
MolecularWeight
258.2942
MdlNumber
MFCD28122686
Smiles
CC(N(S(=O)(=O)C)c1cccc(c1)[N+](=O)[O-])C
Complexity
369
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
5
RotatableBondCount
3
Xlogp3
1.7
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CatalogNumber: AI40431
ChemicalName: N-Isopropyl-N-(3-nitrophenyl)methanesulfonamide
CasNumber: 1820641-75-5
MolecularFormula: C10H14N2O4S
MolecularWeight: 258.2942
MdlNumber: MFCD28122686
Smiles: CC(N(S(=O)(=O)C)c1cccc(c1)[N+](=O)[O-])C
Complexity: 369
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 5
RotatableBondCount: 3
Xlogp3: 1.7
CatalogNumber:
AI40431
ChemicalName:
N-Isopropyl-N-(3-nitrophenyl)methanesulfonamide
CasNumber:
1820641-75-5
MolecularFormula:
C10H14N2O4S
MolecularWeight:
258.2942
MdlNumber:
MFCD28122686
Smiles:
CC(N(S(=O)(=O)C)c1cccc(c1)[N+](=O)[O-])C
Complexity:
369
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
5
RotatableBondCount:
3
Xlogp3:
1.7
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Smiles: COC(=O)c1cccc(c1)c1cc(F)ccc1F
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
COC(=O)c1cccc(c1)c1cc(F)ccc1F
Complexity:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: COC(=O)c1cc(I)c(cc1N)Br
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MolecularFormula:
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Smiles:
COC(=O)c1cc(I)c(cc1N)Br
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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Smiles: Ic1ccccc1C1COC1
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
Ic1ccccc1C1COC1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__