4,6-diphenyl-1,2,3,5-oxathiadiazine 2,2-dioxide

C14H10N2O3S — CID 569716

IUPAC4,6-diphenyl-1,2,3,5-oxathiadiazine 2,2-dioxide
SMILESO=S1(=O)N=C(c2ccccc2)N=C(c2ccccc2)O1
InChIInChI=1S/C14H10N2O3S/c17-20(18)16-13(11-7-3-1-4-8-11)15-14(19-20)12-9-5-2-6-10-12/h1-10H
InChIKeyYUHPJKQTCHNPCH-UHFFFAOYSA-N
MW286.31 g/mol
LogP2.15
Rot. Bonds2

About 4,6-diphenyl-1,2,3,5-oxathiadiazine 2,2-dioxide

4,6-diphenyl-1,2,3,5-oxathiadiazine 2,2-dioxide (PubChem CID 569716) has the molecular formula C14H10N2O3S and a molecular weight of 286.31 g/mol. Its IUPAC name is 4,6-diphenyl-1,2,3,5-oxathiadiazine 2,2-dioxide.

Molecular Properties

Compound Name4,6-diphenyl-1,2,3,5-oxathiadiazine 2,2-dioxide
PubChem CID569716
Molecular FormulaC14H10N2O3S
Molecular Weight286.31 g/mol
Exact Mass286.04
IUPAC Name4,6-diphenyl-1,2,3,5-oxathiadiazine 2,2-dioxide
SMILESO=S1(=O)N=C(c2ccccc2)N=C(c2ccccc2)O1
InChIInChI=1S/C14H10N2O3S/c17-20(18)16-13(11-7-3-1-4-8-11)15-14(19-20)12-9-5-2-6-10-12/h1-10H
InChIKeyYUHPJKQTCHNPCH-UHFFFAOYSA-N
XLogP2.15
TPSA68.09 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.31
LogP ≤ 52.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 4,6-diphenyl-1,2,3,5-oxathiadiazine 2,2-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 4,6-diphenyl-1,2,3,5-oxathiadiazine 2,2-dioxide?
The IUPAC name of 4,6-diphenyl-1,2,3,5-oxathiadiazine 2,2-dioxide (CID 569716) is 4,6-diphenyl-1,2,3,5-oxathiadiazine 2,2-dioxide.
What is the SMILES notation for 4,6-diphenyl-1,2,3,5-oxathiadiazine 2,2-dioxide?
The canonical SMILES for 4,6-diphenyl-1,2,3,5-oxathiadiazine 2,2-dioxide is O=S1(=O)N=C(c2ccccc2)N=C(c2ccccc2)O1.
What is the InChIKey of 4,6-diphenyl-1,2,3,5-oxathiadiazine 2,2-dioxide?
The InChIKey is YUHPJKQTCHNPCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10N2O3S/c17-20(18)16-13(11-7-3-1-4-8-11)15-14(19-20)12-9-5-2-6-10-12/h1-10H.
What are the key properties of 4,6-diphenyl-1,2,3,5-oxathiadiazine 2,2-dioxide?
4,6-diphenyl-1,2,3,5-oxathiadiazine 2,2-dioxide has a molecular weight of 286.31 g/mol, XLogP of 2.15, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-diphenyl-1,2,3,5-oxathiadiazine 2,2-dioxide is sourced from PubChem (CID 569716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).