N-[4-(1,3-thiazolidin-3-ylsulfonyl)phenyl]acetamide

C11H14N2O3S2 — CID 852123

IUPACN-[4-(1,3-thiazolidin-3-ylsulfonyl)phenyl]acetamide
SMILESCC(=O)Nc1ccc(S(=O)(=O)N2CCSC2)cc1
InChIInChI=1S/C11H14N2O3S2/c1-9(14)12-10-2-4-11(5-3-10)18(15,16)13-6-7-17-8-13/h2-5H,6-8H2,1H3,(H,12,14)
InChIKeyKWZDLJYSTPBSSO-UHFFFAOYSA-N
MW286.38 g/mol
LogP1.34
Rot. Bonds3

About N-[4-(1,3-thiazolidin-3-ylsulfonyl)phenyl]acetamide

N-[4-(1,3-thiazolidin-3-ylsulfonyl)phenyl]acetamide (PubChem CID 852123) has the molecular formula C11H14N2O3S2 and a molecular weight of 286.38 g/mol. Its IUPAC name is N-[4-(1,3-thiazolidin-3-ylsulfonyl)phenyl]acetamide.

Molecular Properties

Compound NameN-[4-(1,3-thiazolidin-3-ylsulfonyl)phenyl]acetamide
PubChem CID852123
Molecular FormulaC11H14N2O3S2
Molecular Weight286.38 g/mol
Exact Mass286.04
IUPAC NameN-[4-(1,3-thiazolidin-3-ylsulfonyl)phenyl]acetamide
SMILESCC(=O)Nc1ccc(S(=O)(=O)N2CCSC2)cc1
InChIInChI=1S/C11H14N2O3S2/c1-9(14)12-10-2-4-11(5-3-10)18(15,16)13-6-7-17-8-13/h2-5H,6-8H2,1H3,(H,12,14)
InChIKeyKWZDLJYSTPBSSO-UHFFFAOYSA-N
XLogP1.34
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.38
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[4-(1,3-thiazolidin-3-ylsulfonyl)phenyl]acetamide?
The IUPAC name of N-[4-(1,3-thiazolidin-3-ylsulfonyl)phenyl]acetamide (CID 852123) is N-[4-(1,3-thiazolidin-3-ylsulfonyl)phenyl]acetamide.
What is the SMILES notation for N-[4-(1,3-thiazolidin-3-ylsulfonyl)phenyl]acetamide?
The canonical SMILES for N-[4-(1,3-thiazolidin-3-ylsulfonyl)phenyl]acetamide is CC(=O)Nc1ccc(S(=O)(=O)N2CCSC2)cc1.
What is the InChIKey of N-[4-(1,3-thiazolidin-3-ylsulfonyl)phenyl]acetamide?
The InChIKey is KWZDLJYSTPBSSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O3S2/c1-9(14)12-10-2-4-11(5-3-10)18(15,16)13-6-7-17-8-13/h2-5H,6-8H2,1H3,(H,12,14).
What are the key properties of N-[4-(1,3-thiazolidin-3-ylsulfonyl)phenyl]acetamide?
N-[4-(1,3-thiazolidin-3-ylsulfonyl)phenyl]acetamide has a molecular weight of 286.38 g/mol, XLogP of 1.34, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(1,3-thiazolidin-3-ylsulfonyl)phenyl]acetamide is sourced from PubChem (CID 852123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).