AA59876
139122-20-6 | 4-[2-[[(4-Methylphenyl)sulfonyl]oxy]ethyl]-2-oxoindole
Manufacturer: A2B Chem
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CatalogNumber
AA59876
ChemicalName
4-[2-[[(4-Methylphenyl)sulfonyl]oxy]ethyl]-2-oxoindole
CasNumber
139122-20-6
MolecularFormula
C17H17NO4S
MolecularWeight
331.3862
MdlNumber
MFCD09952011
Smiles
O=C1Cc2c(N1)cccc2CCOS(=O)(=O)c1ccc(cc1)C
Complexity
519
Covalently-bondedUnitCount
1
HeavyAtomCount
23
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
5
Xlogp3
2.2
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CatalogNumber: AA59876
ChemicalName: 4-[2-[[(4-Methylphenyl)sulfonyl]oxy]ethyl]-2-oxoindole
CasNumber: 139122-20-6
MolecularFormula: C17H17NO4S
MolecularWeight: 331.3862
MdlNumber: MFCD09952011
Smiles: O=C1Cc2c(N1)cccc2CCOS(=O)(=O)c1ccc(cc1)C
Complexity: 519
Covalently-bondedUnitCount: 1
HeavyAtomCount: 23
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 5
Xlogp3: 2.2
CatalogNumber:
AA59876
ChemicalName:
4-[2-[[(4-Methylphenyl)sulfonyl]oxy]ethyl]-2-oxoindole
CasNumber:
139122-20-6
MolecularFormula:
C17H17NO4S
MolecularWeight:
331.3862
MdlNumber:
MFCD09952011
Smiles:
O=C1Cc2c(N1)cccc2CCOS(=O)(=O)c1ccc(cc1)C
Complexity:
519
Covalently-bondedUnitCount:
1
HeavyAtomCount:
23
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
5
Xlogp3:
2.2
CatalogNumber: AA59877
ChemicalName: 4-(2-Hydroxyethyl)oxyindole
CasNumber: 139122-19-3
MolecularFormula: C10H11NO2
MolecularWeight: 177.1998
MdlNumber: MFCD07782133
Smiles: OCCc1cccc2c1CC(=O)N2
Complexity: 205
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 2
RotatableBondCount: 2
Xlogp3: 0.2
CatalogNumber:
AA59877
ChemicalName:
4-(2-Hydroxyethyl)oxyindole
CasNumber:
139122-19-3
MolecularFormula:
C10H11NO2
MolecularWeight:
177.1998
MdlNumber:
MFCD07782133
Smiles:
OCCc1cccc2c1CC(=O)N2
Complexity:
205
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
2
RotatableBondCount:
2
Xlogp3:
0.2
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Smiles: O=C1Nc2c(C1)c(CCOC(=O)c1ccccc1)ccc2
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O=C1Nc2c(C1)c(CCOC(=O)c1ccccc1)ccc2
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Smiles: C=CC[C@H](c1ccc(cc1)F)N.Cl
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Smiles:
C=CC[C@H](c1ccc(cc1)F)N.Cl
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