4,4'-Dimethoxythiobenzophenone
TL;DR: 4,4'-Dimethoxythiobenzophenone (CAS 958-80-5) is a chemical compound with molecular formula C15H14O2S and molecular weight 258.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(4-methoxyphenyl)methanethione
Also Known As: 4,4'-Dimethoxythiobenzophenone, Dianisylthioketon, Bis(4-methoxyphenyl)methanethione, Di-p-Anisyl thioketone, 4-phenylbenzohydrazide
| Molecular Formula | C15H14O2S |
|---|---|
| Molecular Weight | 258.07 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 50.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 258.07144 |
| Heavy Atoms | 18 |
| Complexity | 238.0 |
Chemical Identifiers
| CAS Number | 958-80-5 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C(=S)C2=CC=C(C=C2)OC |
| InChIKey | TUKGAYSGFQWDBC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4,4'-Dimethoxythiobenzophenone (CAS 958-80-5), with molecular formula C15H14O2S and molecular weight 258.07 g/mol. IUPAC: bis(4-methoxyphenyl)methanethione.
Chemical Property Profile of 4,4'-Dimethoxythiobenzophenone
Property Insights of 4,4'-Dimethoxythiobenzophenone
The XLogP value of 3.8 indicates that 4,4'-Dimethoxythiobenzophenone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.6 Ų, 4,4'-Dimethoxythiobenzophenone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,4'-Dimethoxythiobenzophenone has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4,4'-Dimethoxythiobenzophenone?
The CAS number of 4,4'-Dimethoxythiobenzophenone is 958-80-5.
What is the molecular formula of 4,4'-Dimethoxythiobenzophenone?
The molecular formula of 4,4'-Dimethoxythiobenzophenone is C15H14O2S.
What is the molecular weight of 4,4'-Dimethoxythiobenzophenone?
The molecular weight of 4,4'-Dimethoxythiobenzophenone is 258.07 g/mol.
Where can I buy 4,4'-Dimethoxythiobenzophenone?
You can request a quote for 4,4'-Dimethoxythiobenzophenone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,4'-Dimethoxythiobenzophenone?
Yes, KEHONG BIO provides custom synthesis services for 4,4'-Dimethoxythiobenzophenone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.