3-Benzyl-2,6-diphenyl-2H-thiopyran-5-carbaldehyde
TL;DR: 3-Benzyl-2,6-diphenyl-2H-thiopyran-5-carbaldehyde (CAS 13589-13-4) is a chemical compound with molecular formula C25H20OS and molecular weight 368.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-benzyl-2,6-diphenyl-2H-thiopyran-5-carbaldehyde
Also Known As: 3-Benzyl-2,6-diphenyl-2H-thiopyran-5-carbaldehyde, 5-Benzyl-2,6-diphenyl-6H-thiopyran-3-carbaldehyde, 3-(ALLYLOXY)ANILINE HYDROCHLORIDE, BAS 01127605, 2H-Thiopyran-5-carboxaldehyde, 3-benzyl-2,6-diphenyl-
| Molecular Formula | C25H20OS |
|---|---|
| Molecular Weight | 368.12 g/mol |
| LogP | 5.7 |
| Topological Polar Surface Area | 42.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 368.12347 |
| Heavy Atoms | 27 |
| Complexity | 557.0 |
Chemical Identifiers
| CAS Number | 13589-13-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)CC2=CC(=C(SC2C3=CC=CC=C3)C4=CC=CC=C4)C=O |
| InChIKey | SFSKQPYRTXDREW-UHFFFAOYSA-N |
Product Overview
3-Benzyl-2,6-diphenyl-2H-thiopyran-5-carbaldehyde (CAS 13589-13-4), with molecular formula C25H20OS and molecular weight 368.12 g/mol. IUPAC: 3-benzyl-2,6-diphenyl-2H-thiopyran-5-carbaldehyde.
Chemical Property Profile of 3-Benzyl-2,6-diphenyl-2H-thiopyran-5-carbaldehyde
Property Insights of 3-Benzyl-2,6-diphenyl-2H-thiopyran-5-carbaldehyde
The XLogP value of 5.7 indicates that 3-Benzyl-2,6-diphenyl-2H-thiopyran-5-carbaldehyde is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.4 Ų, 3-Benzyl-2,6-diphenyl-2H-thiopyran-5-carbaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Benzyl-2,6-diphenyl-2H-thiopyran-5-carbaldehyde has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-Benzyl-2,6-diphenyl-2H-thiopyran-5-carbaldehyde?
The CAS number of 3-Benzyl-2,6-diphenyl-2H-thiopyran-5-carbaldehyde is 13589-13-4.
What is the molecular formula of 3-Benzyl-2,6-diphenyl-2H-thiopyran-5-carbaldehyde?
The molecular formula of 3-Benzyl-2,6-diphenyl-2H-thiopyran-5-carbaldehyde is C25H20OS.
What is the molecular weight of 3-Benzyl-2,6-diphenyl-2H-thiopyran-5-carbaldehyde?
The molecular weight of 3-Benzyl-2,6-diphenyl-2H-thiopyran-5-carbaldehyde is 368.12 g/mol.
Where can I buy 3-Benzyl-2,6-diphenyl-2H-thiopyran-5-carbaldehyde?
You can request a quote for 3-Benzyl-2,6-diphenyl-2H-thiopyran-5-carbaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Benzyl-2,6-diphenyl-2H-thiopyran-5-carbaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 3-Benzyl-2,6-diphenyl-2H-thiopyran-5-carbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.