3,3'-(phenylmethylene)bis(4-hydroxy-2H-thiochromen-2-one)
TL;DR: 3,3'-(phenylmethylene)bis(4-hydroxy-2H-thiochromen-2-one) (CAS 13723-12-1) is a chemical compound with molecular formula C25H16O4S2 and molecular weight 444.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxy-3-[(2-hydroxy-4-oxothiochromen-3-yl)-phenylmethyl]thiochromen-4-one
Also Known As: 3,3'-(phenylmethylene)bis(4-hydroxy-2H-thiochromen-2-one), 3,3'-(phenylmethanediyl)bis(4-hydroxy-2H-thiochromen-2-one), 2-hydroxy-3-[(2-hydroxy-4-oxothiochromen-3-yl)-phenylmethyl]thiochromen-4-one, 2-hydroxy-3-[(2-hydroxy-4-keto-thiochromen-3-yl)-phenyl-methyl]thiochromen-4-one, 2-hydroxy-3-[(2-hydroxy-4-oxo-1-benzothiopyran-3-yl)-phenylmethyl]-1-benzothiopyran-4-one
| Molecular Formula | C25H16O4S2 |
|---|---|
| Molecular Weight | 444.05 g/mol |
| LogP | 5.4278 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 444.049 |
| Heavy Atoms | 31 |
| Complexity | 1452.5149 |
Chemical Identifiers
| CAS Number | 13723-12-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(C2=C(SC3=CC=CC=C3C2=O)O)C4=C(SC5=CC=CC=C5C4=O)O |
Product Overview
3,3'-(phenylmethylene)bis(4-hydroxy-2H-thiochromen-2-one) (CAS 13723-12-1), with molecular formula C25H16O4S2 and molecular weight 444.05 g/mol. IUPAC: 2-hydroxy-3-[(2-hydroxy-4-oxothiochromen-3-yl)-phenylmethyl]thiochromen-4-one.
Chemical Property Profile of 3,3'-(phenylmethylene)bis(4-hydroxy-2H-thiochromen-2-one)
Property Insights of 3,3'-(phenylmethylene)bis(4-hydroxy-2H-thiochromen-2-one)
The XLogP value of 5.4278 indicates that 3,3'-(phenylmethylene)bis(4-hydroxy-2H-thiochromen-2-one) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,3'-(phenylmethylene)bis(4-hydroxy-2H-thiochromen-2-one). Following Lipinski's Rule of Five, 3,3'-(phenylmethylene)bis(4-hydroxy-2H-thiochromen-2-one) has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3,3'-(phenylmethylene)bis(4-hydroxy-2H-thiochromen-2-one)?
The CAS number of 3,3'-(phenylmethylene)bis(4-hydroxy-2H-thiochromen-2-one) is 13723-12-1.
What is the molecular formula of 3,3'-(phenylmethylene)bis(4-hydroxy-2H-thiochromen-2-one)?
The molecular formula of 3,3'-(phenylmethylene)bis(4-hydroxy-2H-thiochromen-2-one) is C25H16O4S2.
What is the molecular weight of 3,3'-(phenylmethylene)bis(4-hydroxy-2H-thiochromen-2-one)?
The molecular weight of 3,3'-(phenylmethylene)bis(4-hydroxy-2H-thiochromen-2-one) is 444.05 g/mol.
Where can I buy 3,3'-(phenylmethylene)bis(4-hydroxy-2H-thiochromen-2-one)?
You can request a quote for 3,3'-(phenylmethylene)bis(4-hydroxy-2H-thiochromen-2-one) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3'-(phenylmethylene)bis(4-hydroxy-2H-thiochromen-2-one)?
Yes, KEHONG BIO provides custom synthesis services for 3,3'-(phenylmethylene)bis(4-hydroxy-2H-thiochromen-2-one) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.