(3S,4R)-3,4-diphenyl-1,2,5-thiadiazolidine 1,1-dioxide

C14H14N2O2S — CID 95561844

IUPAC(3S,4R)-3,4-diphenyl-1,2,5-thiadiazolidine 1,1-dioxide
SMILESO=S1(=O)N[C@H](c2ccccc2)[C@H](c2ccccc2)N1
InChIInChI=1S/C14H14N2O2S/c17-19(18)15-13(11-7-3-1-4-8-11)14(16-19)12-9-5-2-6-10-12/h1-10,13-16H/t13-,14+
InChIKeyCQFMYKOPDSGUGD-OKILXGFUSA-N
MW274.35 g/mol
LogP1.91
Rot. Bonds2

About (3S,4R)-3,4-diphenyl-1,2,5-thiadiazolidine 1,1-dioxide

(3S,4R)-3,4-diphenyl-1,2,5-thiadiazolidine 1,1-dioxide (PubChem CID 95561844) has the molecular formula C14H14N2O2S and a molecular weight of 274.35 g/mol. Its IUPAC name is (3S,4R)-3,4-diphenyl-1,2,5-thiadiazolidine 1,1-dioxide.

Molecular Properties

Compound Name(3S,4R)-3,4-diphenyl-1,2,5-thiadiazolidine 1,1-dioxide
PubChem CID95561844
Molecular FormulaC14H14N2O2S
Molecular Weight274.35 g/mol
Exact Mass274.08
IUPAC Name(3S,4R)-3,4-diphenyl-1,2,5-thiadiazolidine 1,1-dioxide
SMILESO=S1(=O)N[C@H](c2ccccc2)[C@H](c2ccccc2)N1
InChIInChI=1S/C14H14N2O2S/c17-19(18)15-13(11-7-3-1-4-8-11)14(16-19)12-9-5-2-6-10-12/h1-10,13-16H/t13-,14+
InChIKeyCQFMYKOPDSGUGD-OKILXGFUSA-N
XLogP1.91
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.35
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze (3S,4R)-3,4-diphenyl-1,2,5-thiadiazolidine 1,1-dioxide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (3S,4R)-3,4-diphenyl-1,2,5-thiadiazolidine 1,1-dioxide?
The IUPAC name of (3S,4R)-3,4-diphenyl-1,2,5-thiadiazolidine 1,1-dioxide (CID 95561844) is (3S,4R)-3,4-diphenyl-1,2,5-thiadiazolidine 1,1-dioxide.
What is the SMILES notation for (3S,4R)-3,4-diphenyl-1,2,5-thiadiazolidine 1,1-dioxide?
The canonical SMILES for (3S,4R)-3,4-diphenyl-1,2,5-thiadiazolidine 1,1-dioxide is O=S1(=O)N[C@H](c2ccccc2)[C@H](c2ccccc2)N1.
What is the InChIKey of (3S,4R)-3,4-diphenyl-1,2,5-thiadiazolidine 1,1-dioxide?
The InChIKey is CQFMYKOPDSGUGD-OKILXGFUSA-N. The full InChI is InChI=1S/C14H14N2O2S/c17-19(18)15-13(11-7-3-1-4-8-11)14(16-19)12-9-5-2-6-10-12/h1-10,13-16H/t13-,14+.
What are the key properties of (3S,4R)-3,4-diphenyl-1,2,5-thiadiazolidine 1,1-dioxide?
(3S,4R)-3,4-diphenyl-1,2,5-thiadiazolidine 1,1-dioxide has a molecular weight of 274.35 g/mol, XLogP of 1.91, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3S,4R)-3,4-diphenyl-1,2,5-thiadiazolidine 1,1-dioxide is sourced from PubChem (CID 95561844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).