CDS1_003580
TL;DR: CDS1_003580 (CAS 302823-86-5) is a chemical compound with molecular formula C18H13NO4S2 and molecular weight 371.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-5-(1,3-benzodioxol-5-ylmethylidene)-3-(4-methoxyphenyl)-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: CDS1_003580, BAS 00664164, (5Z)-5-(1,3-benzodioxol-5-ylmethylidene)-3-(4-methoxyphenyl)-2-thioxo-1,3-thiazolidin-4-one, (Z)-5-(benzo[d][1,3]dioxol-5-ylmethylene)-3-(4-methoxyphenyl)-2-thioxothiazolidin-4-one, (5Z)-5-(1,3-benzodioxol-5-ylmethylidene)-3-(4-methoxyphenyl)-2-sulfanylidene-1,3-thiazolidin-4-one
| Molecular Formula | C18H13NO4S2 |
|---|---|
| Molecular Weight | 371.03 g/mol |
| LogP | 3.8297 |
| Topological Polar Surface Area | 48.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 371.0286 |
| Heavy Atoms | 25 |
| Complexity | 892.4491 |
Chemical Identifiers
| CAS Number | 302823-86-5 |
|---|---|
| SMILES | COC1=CC=C(C=C1)N2C(=O)/C(=C/C3=CC4=C(C=C3)OCO4)/SC2=S |
Product Overview
CDS1_003580 (CAS 302823-86-5), with molecular formula C18H13NO4S2 and molecular weight 371.03 g/mol. IUPAC: (5Z)-5-(1,3-benzodioxol-5-ylmethylidene)-3-(4-methoxyphenyl)-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of CDS1_003580
Property Insights of CDS1_003580
The XLogP value of 3.8297 indicates that CDS1_003580 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.0 Ų, CDS1_003580 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, CDS1_003580 has 0 hydrogen bond donor(s) and 6 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 CDS1_003580?
The CAS number of CDS1_003580 is 302823-86-5.
What is the molecular formula of CDS1_003580?
The molecular formula of CDS1_003580 is C18H13NO4S2.
What is the molecular weight of CDS1_003580?
The molecular weight of CDS1_003580 is 371.03 g/mol.
Where can I buy CDS1_003580?
You can request a quote for CDS1_003580 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CDS1_003580?
Yes, KEHONG BIO provides custom synthesis services for CDS1_003580 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.