2,3-Dibenzoyl-2,3-diphenylthiirane-1,1-dione
TL;DR: 2,3-Dibenzoyl-2,3-diphenylthiirane-1,1-dione (CAS 989-21-9) is a chemical compound with molecular formula C28H20O4S and molecular weight 452.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-benzoyl-1,1-dioxo-2,3-diphenylthiiran-2-yl)-phenylmethanone
Also Known As: Dibenzoylstilben-episulfon, 2,3-Dibenzoyl-2,3-diphenylthiirane-1,1-dione, AE-477/13519469, (1,1-dioxido-2,3-diphenylthiirane-2,3-diyl)bis(phenylmethanone), (3-benzoyl-1,1-dioxo-2,3-diphenylthiiran-2-yl)-phenylmethanone
| Molecular Formula | C28H20O4S |
|---|---|
| Molecular Weight | 452.11 g/mol |
| LogP | 5.2 |
| Topological Polar Surface Area | 76.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 452.10822 |
| Heavy Atoms | 33 |
| Complexity | 770.0 |
Chemical Identifiers
| CAS Number | 989-21-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)C2(C(S2(=O)=O)(C3=CC=CC=C3)C(=O)C4=CC=CC=C4)C5=CC=CC=C5 |
| InChIKey | RHISAXAFLNJXAT-UHFFFAOYSA-N |
Product Overview
2,3-Dibenzoyl-2,3-diphenylthiirane-1,1-dione (CAS 989-21-9), with molecular formula C28H20O4S and molecular weight 452.11 g/mol. IUPAC: (3-benzoyl-1,1-dioxo-2,3-diphenylthiiran-2-yl)-phenylmethanone.
Chemical Property Profile of 2,3-Dibenzoyl-2,3-diphenylthiirane-1,1-dione
Property Insights of 2,3-Dibenzoyl-2,3-diphenylthiirane-1,1-dione
The XLogP value of 5.2 indicates that 2,3-Dibenzoyl-2,3-diphenylthiirane-1,1-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,3-Dibenzoyl-2,3-diphenylthiirane-1,1-dione. Following Lipinski's Rule of Five, 2,3-Dibenzoyl-2,3-diphenylthiirane-1,1-dione has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,3-Dibenzoyl-2,3-diphenylthiirane-1,1-dione?
The CAS number of 2,3-Dibenzoyl-2,3-diphenylthiirane-1,1-dione is 989-21-9.
What is the molecular formula of 2,3-Dibenzoyl-2,3-diphenylthiirane-1,1-dione?
The molecular formula of 2,3-Dibenzoyl-2,3-diphenylthiirane-1,1-dione is C28H20O4S.
What is the molecular weight of 2,3-Dibenzoyl-2,3-diphenylthiirane-1,1-dione?
The molecular weight of 2,3-Dibenzoyl-2,3-diphenylthiirane-1,1-dione is 452.11 g/mol.
Where can I buy 2,3-Dibenzoyl-2,3-diphenylthiirane-1,1-dione?
You can request a quote for 2,3-Dibenzoyl-2,3-diphenylthiirane-1,1-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3-Dibenzoyl-2,3-diphenylthiirane-1,1-dione?
Yes, KEHONG BIO provides custom synthesis services for 2,3-Dibenzoyl-2,3-diphenylthiirane-1,1-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.