4-[(4R)-4-(4-chloro-3-hydroxyphenyl)-2-oxopyrrolidin-1-yl]benzenesulfonamide

C16H15ClN2O4S — CID 70966696

IUPAC4-[(4R)-4-(4-chloro-3-hydroxyphenyl)-2-oxopyrrolidin-1-yl]benzenesulfonamide
SMILESNS(=O)(=O)c1ccc(N2C[C@@H](c3ccc(Cl)c(O)c3)CC2=O)cc1
InChIInChI=1S/C16H15ClN2O4S/c17-14-6-1-10(7-15(14)20)11-8-16(21)19(9-11)12-2-4-13(5-3-12)24(18,22)23/h1-7,11,20H,8-9H2,(H2,18,22,23)/t11-/m0/s1
InChIKeyUXQRJIVZQRSXOW-NSHDSACASA-N
MW366.83 g/mol
LogP2.21
Rot. Bonds3

About 4-[(4R)-4-(4-chloro-3-hydroxyphenyl)-2-oxopyrrolidin-1-yl]benzenesulfonamide

4-[(4R)-4-(4-chloro-3-hydroxyphenyl)-2-oxopyrrolidin-1-yl]benzenesulfonamide (PubChem CID 70966696) has the molecular formula C16H15ClN2O4S and a molecular weight of 366.83 g/mol. Its IUPAC name is 4-[(4R)-4-(4-chloro-3-hydroxyphenyl)-2-oxopyrrolidin-1-yl]benzenesulfonamide.

Molecular Properties

Compound Name4-[(4R)-4-(4-chloro-3-hydroxyphenyl)-2-oxopyrrolidin-1-yl]benzenesulfonamide
PubChem CID70966696
Molecular FormulaC16H15ClN2O4S
Molecular Weight366.83 g/mol
Exact Mass366.04
IUPAC Name4-[(4R)-4-(4-chloro-3-hydroxyphenyl)-2-oxopyrrolidin-1-yl]benzenesulfonamide
SMILESNS(=O)(=O)c1ccc(N2C[C@@H](c3ccc(Cl)c(O)c3)CC2=O)cc1
InChIInChI=1S/C16H15ClN2O4S/c17-14-6-1-10(7-15(14)20)11-8-16(21)19(9-11)12-2-4-13(5-3-12)24(18,22)23/h1-7,11,20H,8-9H2,(H2,18,22,23)/t11-/m0/s1
InChIKeyUXQRJIVZQRSXOW-NSHDSACASA-N
XLogP2.21
TPSA100.70 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.83
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-[(4R)-4-[4-chloro-3-(2-chloro-6-cyano-3-methoxyphenoxy)phenyl]-2-oxopyrrolidin-1-yl]benzenesulfonamide
CID 71029337
1-(4-chloro-3-hydroxyphenyl)-4-hydroxypyrrolidin-2-one
CID 168703378
4-[(4R)-4-[4-chloro-3-(2-chloro-6-cyanophenoxy)phenyl]-2-methylidenepyrrolidin-1-yl]benzenesulfonamide
CID 89203938
[1-(3-chloro-4-hydroxyphenyl)-5-oxopyrrolidin-3-yl]methanesulfonamide
CID 168682499
4-[(4R)-4-[4-cyano-3-(2-cyanophenoxy)phenyl]-2-methylidenepyrrolidin-1-yl]benzenesulfonamide
CID 89146165
3-[(4R)-4-[4-chloro-3-(3-chloro-2-cyano-6-methylphenoxy)phenyl]-2-oxopyrrolidin-1-yl]benzamide;4-[(4R)-4-[3-(2-chloro-6-methylphenoxy)-4-cyanophenyl]-2-oxopyrrolidin-1-yl]benzenesulfonamide;4-[(4R)-4-[3-(2-chlorophenoxy)-4-cyanophenyl]-2-oxopyrrolidin-1-yl]benzenesulfonamide;4-[(4R)-4-[3-(3-chlorophenoxy)-4-cyanophenyl]-2-oxopyrrolidin-1-yl]benzenesulfonamide
CID 158835860
1-(4-cyclohexylphenyl)-5-oxopyrrolidine-3-sulfonamide
CID 168719322
1-[1-(4-fluorophenyl)-5-oxopyrrolidin-3-yl]-3-(4-sulfamoylphenyl)urea
CID 16819889
4-[4-[4-chloro-2-[2-cyano-6-(trifluoromethyl)phenoxy]phenyl]-2-oxopyrrolidin-1-yl]benzenesulfonamide
CID 76568305
1-(4-chloro-3-methoxyphenyl)-5-oxopyrrolidine-3-sulfonamide
CID 168717379
(4R)-1-[3-(1-aminoethenyl)phenyl]-4-[4-chloro-3-(2-chlorophenoxy)phenyl]pyrrolidin-2-one
CID 89146166
4-[2-[[(3R)-1-(3,4-dichlorophenyl)-2,5-dioxopyrrolidin-3-yl]amino]ethyl]benzenesulfonamide
CID 1090820

Frequently Asked Questions

What is the IUPAC name of 4-[(4R)-4-(4-chloro-3-hydroxyphenyl)-2-oxopyrrolidin-1-yl]benzenesulfonamide?
The IUPAC name of 4-[(4R)-4-(4-chloro-3-hydroxyphenyl)-2-oxopyrrolidin-1-yl]benzenesulfonamide (CID 70966696) is 4-[(4R)-4-(4-chloro-3-hydroxyphenyl)-2-oxopyrrolidin-1-yl]benzenesulfonamide.
What is the SMILES notation for 4-[(4R)-4-(4-chloro-3-hydroxyphenyl)-2-oxopyrrolidin-1-yl]benzenesulfonamide?
The canonical SMILES for 4-[(4R)-4-(4-chloro-3-hydroxyphenyl)-2-oxopyrrolidin-1-yl]benzenesulfonamide is NS(=O)(=O)c1ccc(N2C[C@@H](c3ccc(Cl)c(O)c3)CC2=O)cc1.
What is the InChIKey of 4-[(4R)-4-(4-chloro-3-hydroxyphenyl)-2-oxopyrrolidin-1-yl]benzenesulfonamide?
The InChIKey is UXQRJIVZQRSXOW-NSHDSACASA-N. The full InChI is InChI=1S/C16H15ClN2O4S/c17-14-6-1-10(7-15(14)20)11-8-16(21)19(9-11)12-2-4-13(5-3-12)24(18,22)23/h1-7,11,20H,8-9H2,(H2,18,22,23)/t11-/m0/s1.
What are the key properties of 4-[(4R)-4-(4-chloro-3-hydroxyphenyl)-2-oxopyrrolidin-1-yl]benzenesulfonamide?
4-[(4R)-4-(4-chloro-3-hydroxyphenyl)-2-oxopyrrolidin-1-yl]benzenesulfonamide has a molecular weight of 366.83 g/mol, XLogP of 2.21, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4R)-4-(4-chloro-3-hydroxyphenyl)-2-oxopyrrolidin-1-yl]benzenesulfonamide is sourced from PubChem (CID 70966696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).