N-[(2R)-2-(4-methoxyphenyl)-4-oxo-1,3-thiazolidin-3-yl]benzenesulfonamide

C16H16N2O4S2 — CID 1286782

IUPACN-[(2R)-2-(4-methoxyphenyl)-4-oxo-1,3-thiazolidin-3-yl]benzenesulfonamide
SMILESCOc1ccc([C@H]2SCC(=O)N2NS(=O)(=O)c2ccccc2)cc1
InChIInChI=1S/C16H16N2O4S2/c1-22-13-9-7-12(8-10-13)16-18(15(19)11-23-16)17-24(20,21)14-5-3-2-4-6-14/h2-10,16-17H,11H2,1H3/t16-/m1/s1
InChIKeyJCZZYBPTWCUPAZ-MRXNPFEDSA-N
MW364.45 g/mol
LogP2.16
Rot. Bonds5

About N-[(2R)-2-(4-methoxyphenyl)-4-oxo-1,3-thiazolidin-3-yl]benzenesulfonamide

N-[(2R)-2-(4-methoxyphenyl)-4-oxo-1,3-thiazolidin-3-yl]benzenesulfonamide (PubChem CID 1286782) has the molecular formula C16H16N2O4S2 and a molecular weight of 364.45 g/mol. Its IUPAC name is N-[(2R)-2-(4-methoxyphenyl)-4-oxo-1,3-thiazolidin-3-yl]benzenesulfonamide.

Molecular Properties

Compound NameN-[(2R)-2-(4-methoxyphenyl)-4-oxo-1,3-thiazolidin-3-yl]benzenesulfonamide
PubChem CID1286782
Molecular FormulaC16H16N2O4S2
Molecular Weight364.45 g/mol
Exact Mass364.06
IUPAC NameN-[(2R)-2-(4-methoxyphenyl)-4-oxo-1,3-thiazolidin-3-yl]benzenesulfonamide
SMILESCOc1ccc([C@H]2SCC(=O)N2NS(=O)(=O)c2ccccc2)cc1
InChIInChI=1S/C16H16N2O4S2/c1-22-13-9-7-12(8-10-13)16-18(15(19)11-23-16)17-24(20,21)14-5-3-2-4-6-14/h2-10,16-17H,11H2,1H3/t16-/m1/s1
InChIKeyJCZZYBPTWCUPAZ-MRXNPFEDSA-N
XLogP2.16
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.45
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-[(2R)-3-(4-methoxyphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]benzenesulfonamide
CID 93125434
4-fluoro-N-[(2S)-2-(4-fluorophenyl)-4-oxo-1,3-thiazolidin-3-yl]benzenesulfonamide
CID 1270154
4-fluoro-N-[2-(4-fluorophenyl)-4-oxo-1,3-thiazolidin-3-yl]benzenesulfonamide
CID 3798545
2-(4-methoxyphenyl)-3-phenyl-1,3-thiazolidin-4-one
CID 2839840
(2R)-3-(4-methoxyphenyl)-2-(4-phenoxyphenyl)-1,3-thiazolidin-4-one
CID 1274265
4-methoxy-N-[4-[3-(4-methoxyphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]benzenesulfonamide
CID 42804735
2-carbazol-9-yl-N-[2-(4-methoxyphenyl)-4-oxo-1,3-thiazolidin-3-yl]acetamide
CID 10812585
(2S)-2-(4-methoxyphenyl)-3-(2-phenylethyl)-1,3-thiazolidin-4-one
CID 720979
4-fluoro-N-[4-[3-(4-methoxyphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]benzenesulfonamide
CID 42804733
N-[2-(4-methoxyphenyl)-4-oxo-1,3-thiazolidin-3-yl]-3,5-dinitrobenzamide
CID 15272755
N-[4-[(4-methoxyphenyl)sulfamoyl]phenyl]-4-[(2R)-4-oxo-3-(2-phenylethyl)-1,3-thiazolidin-2-yl]benzamide
CID 126190058
2-(1,3-benzoxazol-2-ylsulfanyl)-N-[2-(4-methoxyphenyl)-4-oxo-1,3-thiazolidin-3-yl]acetamide
CID 15946683

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2-(4-methoxyphenyl)-4-oxo-1,3-thiazolidin-3-yl]benzenesulfonamide?
The IUPAC name of N-[(2R)-2-(4-methoxyphenyl)-4-oxo-1,3-thiazolidin-3-yl]benzenesulfonamide (CID 1286782) is N-[(2R)-2-(4-methoxyphenyl)-4-oxo-1,3-thiazolidin-3-yl]benzenesulfonamide.
What is the SMILES notation for N-[(2R)-2-(4-methoxyphenyl)-4-oxo-1,3-thiazolidin-3-yl]benzenesulfonamide?
The canonical SMILES for N-[(2R)-2-(4-methoxyphenyl)-4-oxo-1,3-thiazolidin-3-yl]benzenesulfonamide is COc1ccc([C@H]2SCC(=O)N2NS(=O)(=O)c2ccccc2)cc1.
What is the InChIKey of N-[(2R)-2-(4-methoxyphenyl)-4-oxo-1,3-thiazolidin-3-yl]benzenesulfonamide?
The InChIKey is JCZZYBPTWCUPAZ-MRXNPFEDSA-N. The full InChI is InChI=1S/C16H16N2O4S2/c1-22-13-9-7-12(8-10-13)16-18(15(19)11-23-16)17-24(20,21)14-5-3-2-4-6-14/h2-10,16-17H,11H2,1H3/t16-/m1/s1.
What are the key properties of N-[(2R)-2-(4-methoxyphenyl)-4-oxo-1,3-thiazolidin-3-yl]benzenesulfonamide?
N-[(2R)-2-(4-methoxyphenyl)-4-oxo-1,3-thiazolidin-3-yl]benzenesulfonamide has a molecular weight of 364.45 g/mol, XLogP of 2.16, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2-(4-methoxyphenyl)-4-oxo-1,3-thiazolidin-3-yl]benzenesulfonamide is sourced from PubChem (CID 1286782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).