5-(1,3-benzodioxol-5-ylmethylidene)-1,3-diphenyl-2-sulfanylidene-1,3-diazinane-4,6-dione
TL;DR: 5-(1,3-benzodioxol-5-ylmethylidene)-1,3-diphenyl-2-sulfanylidene-1,3-diazinane-4,6-dione (CAS 357177-49-2) is a chemical compound with molecular formula C24H16N2O4S and molecular weight 428.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(1,3-benzodioxol-5-ylmethylidene)-1,3-diphenyl-2-sulfanylidene-1,3-diazinane-4,6-dione
Also Known As: 5-(1,3-benzodioxol-5-ylmethylidene)-1,3-diphenyl-2-sulfanylidene-1,3-diazinane-4,6-dione, 5-(benzo[1,3]dioxol-5-ylmethylidene)-1,3-diphenyl-2-sulfanylidene-1,3-diazinane-4,6-dione, 5-(1,3-benzodioxol-5-ylmethylidene)-1,3-diphenyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione, 5-(benzo[d][1,3]dioxol-5-ylmethylene)-1,3-diphenyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
| Molecular Formula | C24H16N2O4S |
|---|---|
| Molecular Weight | 428.08 g/mol |
| LogP | 4.1636 |
| Topological Polar Surface Area | 59.08 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 428.08307 |
| Heavy Atoms | 31 |
| Complexity | 1161.3414 |
Chemical Identifiers
| CAS Number | 357177-49-2 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)C=C3C(=O)N(C(=S)N(C3=O)C4=CC=CC=C4)C5=CC=CC=C5 |
Product Overview
5-(1,3-benzodioxol-5-ylmethylidene)-1,3-diphenyl-2-sulfanylidene-1,3-diazinane-4,6-dione (CAS 357177-49-2), with molecular formula C24H16N2O4S and molecular weight 428.08 g/mol. IUPAC: 5-(1,3-benzodioxol-5-ylmethylidene)-1,3-diphenyl-2-sulfanylidene-1,3-diazinane-4,6-dione.
Chemical Property Profile of 5-(1,3-benzodioxol-5-ylmethylidene)-1,3-diphenyl-2-sulfanylidene-1,3-diazinane-4,6-dione
Property Insights of 5-(1,3-benzodioxol-5-ylmethylidene)-1,3-diphenyl-2-sulfanylidene-1,3-diazinane-4,6-dione
The XLogP value of 4.1636 indicates that 5-(1,3-benzodioxol-5-ylmethylidene)-1,3-diphenyl-2-sulfanylidene-1,3-diazinane-4,6-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.08 Ų, 5-(1,3-benzodioxol-5-ylmethylidene)-1,3-diphenyl-2-sulfanylidene-1,3-diazinane-4,6-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(1,3-benzodioxol-5-ylmethylidene)-1,3-diphenyl-2-sulfanylidene-1,3-diazinane-4,6-dione has 0 hydrogen bond donor(s) and 5 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 5-(1,3-benzodioxol-5-ylmethylidene)-1,3-diphenyl-2-sulfanylidene-1,3-diazinane-4,6-dione?
The CAS number of 5-(1,3-benzodioxol-5-ylmethylidene)-1,3-diphenyl-2-sulfanylidene-1,3-diazinane-4,6-dione is 357177-49-2.
What is the molecular formula of 5-(1,3-benzodioxol-5-ylmethylidene)-1,3-diphenyl-2-sulfanylidene-1,3-diazinane-4,6-dione?
The molecular formula of 5-(1,3-benzodioxol-5-ylmethylidene)-1,3-diphenyl-2-sulfanylidene-1,3-diazinane-4,6-dione is C24H16N2O4S.
What is the molecular weight of 5-(1,3-benzodioxol-5-ylmethylidene)-1,3-diphenyl-2-sulfanylidene-1,3-diazinane-4,6-dione?
The molecular weight of 5-(1,3-benzodioxol-5-ylmethylidene)-1,3-diphenyl-2-sulfanylidene-1,3-diazinane-4,6-dione is 428.08 g/mol.
Where can I buy 5-(1,3-benzodioxol-5-ylmethylidene)-1,3-diphenyl-2-sulfanylidene-1,3-diazinane-4,6-dione?
You can request a quote for 5-(1,3-benzodioxol-5-ylmethylidene)-1,3-diphenyl-2-sulfanylidene-1,3-diazinane-4,6-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(1,3-benzodioxol-5-ylmethylidene)-1,3-diphenyl-2-sulfanylidene-1,3-diazinane-4,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 5-(1,3-benzodioxol-5-ylmethylidene)-1,3-diphenyl-2-sulfanylidene-1,3-diazinane-4,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.