2-((4-(3-(4-Chlorophenyl)-4,5-dihydro-1H-pyrazol-1-yl)phenyl)sulphonyl)ethanol
Basic information
- CAS
3656-22-2- Standard SMILES
O=S(=O)(CCO)c1ccc(N2CCC(c3ccc(Cl)cc3)=N2)cc1- InChIKey
WCXDRTSNSUAZLB-UHFFFAOYSA-N- Molecular formula
- C17H17ClN2O3S
- Average molar mass
- 364.8 g/mol
- Monoisotopic mass
- 364.0648413
Names & identifiers
- Preferred name
- 2-((4-(3-(4-Chlorophenyl)-4,5-dihydro-1H-pyrazol-1-yl)phenyl)sulphonyl)ethanol
- IUPAC
- 2-[4-[5-(4-chlorophenyl)-3,4-dihydropyrazol-2-yl]phenyl]sulfonylethanol
- English name
- 2-[[4-[3-(4-chlorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]phenyl]sulphonyl]ethanol
- Molecular formula
- C17H17ClN2O3S
- Molecular weight
- 364.85
Names & synonyms
3656-22-22-((4-(3-(4-Chlorophenyl)-4,5-dihydro-1H-pyrazol-1-yl)phenyl)sulphonyl)ethanol2-[[4-[3-(4-chlorophenyl)-4,5-dihydro-1h-pyrazol-1-yl]phenyl]sulphonyl]ethanol2-((4-(3-(4-Chlorophenyl)-4,5-dihydro-1H-pyrazol-1-yl)phenyl)sulfonyl)ethanol2-({4-[3-(4-chlorophenyl)-4,5-dihydro-1h-pyrazol-1-yl]phenyl}sulfonyl)ethanolEINECS 222-902-5SCHEMBL3139976DTXSID90190065WCXDRTSNSUAZLB-UHFFFAOYSA-NNS000300582-{4-[3-(4-Chlorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]benzene-1-sulfonyl}ethan-1-ol2-[4-[5-(4-chlorophenyl)-3,4-dihydropyrazol-2-yl]phenyl]sulfonylethano
Show more names
2-[[4-[3-(4-Chlorphenyl)-4,5-dihydro-1H-pyrazol-1-yl]phenyl]sulfonyl]ethanol2-[[4-[3-(4-Chlorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]phenyl]sulfonyl]ethanolEthanol, 2-[[4-[3-(4-chlorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]phenyl]sulfonyl]-2-[[4-[3-(4-Chlorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]phenyl]sulphonyl]ethanol 2-[[4-[3-(4-chlorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]phenyl]sulfonyl]-Ethanol
Database identifiers
- CAS
3656-22-2- PubChem CID
- 77218
- DTXSID
DTXSID90190065- EC Number
- 222-902-5
- Nikkaji
- J205.574K
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 78.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 545
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Compound notes
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