![3-(benzo[d][1,3]dioxol-5-yl)-7-methoxy-2-methyl-6-propyl-4H-chromene-4-thione structure](/static/products/313/313253-81-5.png)
3-(benzo[d][1,3]dioxol-5-yl)-7-methoxy-2-methyl-6-propyl-4H-chromene-4-thione
TL;DR: 3-(benzo[d][1,3]dioxol-5-yl)-7-methoxy-2-methyl-6-propyl-4H-chromene-4-thione (CAS 313253-81-5) is a chemical compound with molecular formula C21H20O4S and molecular weight 368.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1,3-benzodioxol-5-yl)-7-methoxy-2-methyl-6-propylchromene-4-thione
Also Known As: 3-(benzo[d][1,3]dioxol-5-yl)-7-methoxy-2-methyl-6-propyl-4H-chromene-4-thione, 3-(1,3-benzodioxol-5-yl)-7-methoxy-2-methyl-6-propylchromene-4-thione, 3-(1,3-benzodioxol-5-yl)-7-methoxy-2-methyl-6-propyl-4H-chromene-4-thione
| Molecular Formula | C21H20O4S |
|---|---|
| Molecular Weight | 368.11 g/mol |
| LogP | 5.82751 |
| Topological Polar Surface Area | 40.83 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 368.10822 |
| Heavy Atoms | 26 |
| Complexity | 1052.0409 |
Chemical Identifiers
| CAS Number | 313253-81-5 |
|---|---|
| SMILES | CCCC1=CC2=C(C=C1OC)OC(=C(C2=S)C3=CC4=C(C=C3)OCO4)C |
Product Overview
3-(benzo[d][1,3]dioxol-5-yl)-7-methoxy-2-methyl-6-propyl-4H-chromene-4-thione (CAS 313253-81-5), with molecular formula C21H20O4S and molecular weight 368.11 g/mol. IUPAC: 3-(1,3-benzodioxol-5-yl)-7-methoxy-2-methyl-6-propylchromene-4-thione.
Chemical Property Profile of 3-(benzo[d][1,3]dioxol-5-yl)-7-methoxy-2-methyl-6-propyl-4H-chromene-4-thione
Property Insights of 3-(benzo[d][1,3]dioxol-5-yl)-7-methoxy-2-methyl-6-propyl-4H-chromene-4-thione
The XLogP value of 5.82751 indicates that 3-(benzo[d][1,3]dioxol-5-yl)-7-methoxy-2-methyl-6-propyl-4H-chromene-4-thione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.83 Ų, 3-(benzo[d][1,3]dioxol-5-yl)-7-methoxy-2-methyl-6-propyl-4H-chromene-4-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(benzo[d][1,3]dioxol-5-yl)-7-methoxy-2-methyl-6-propyl-4H-chromene-4-thione has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-(benzo[d][1,3]dioxol-5-yl)-7-methoxy-2-methyl-6-propyl-4H-chromene-4-thione?
The CAS number of 3-(benzo[d][1,3]dioxol-5-yl)-7-methoxy-2-methyl-6-propyl-4H-chromene-4-thione is 313253-81-5.
What is the molecular formula of 3-(benzo[d][1,3]dioxol-5-yl)-7-methoxy-2-methyl-6-propyl-4H-chromene-4-thione?
The molecular formula of 3-(benzo[d][1,3]dioxol-5-yl)-7-methoxy-2-methyl-6-propyl-4H-chromene-4-thione is C21H20O4S.
What is the molecular weight of 3-(benzo[d][1,3]dioxol-5-yl)-7-methoxy-2-methyl-6-propyl-4H-chromene-4-thione?
The molecular weight of 3-(benzo[d][1,3]dioxol-5-yl)-7-methoxy-2-methyl-6-propyl-4H-chromene-4-thione is 368.11 g/mol.
Where can I buy 3-(benzo[d][1,3]dioxol-5-yl)-7-methoxy-2-methyl-6-propyl-4H-chromene-4-thione?
You can request a quote for 3-(benzo[d][1,3]dioxol-5-yl)-7-methoxy-2-methyl-6-propyl-4H-chromene-4-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(benzo[d][1,3]dioxol-5-yl)-7-methoxy-2-methyl-6-propyl-4H-chromene-4-thione?
Yes, KEHONG BIO provides custom synthesis services for 3-(benzo[d][1,3]dioxol-5-yl)-7-methoxy-2-methyl-6-propyl-4H-chromene-4-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.