ChemDiv2_004569
TL;DR: ChemDiv2_004569 (CAS 522652-58-0) is a chemical compound with molecular formula C13H10N4OS4 and molecular weight 365.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-phenyl-5-sulfanylidene-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(1,3-thiazol-2-yl)acetamide
Also Known As: ChemDiv2_004569, IDI1_003284, 2-[(4-phenyl-5-thioxo-4,5-dihydro-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(1,3-thiazol-2-yl)acetamide, 2-((4-phenyl-5-thioxo-4,5-dihydro-1,3,4-thiadiazol-2-yl)thio)-N-(thiazol-2-yl)acetamide, 2-[(4-phenyl-5-sulfanylidene-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(1,3-thiazol-2-yl)acetamide
| Molecular Formula | C13H10N4OS4 |
|---|---|
| Molecular Weight | 365.97 g/mol |
| LogP | 3.85059 |
| Topological Polar Surface Area | 59.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 365.97375 |
| Heavy Atoms | 22 |
| Complexity | 810.195 |
Chemical Identifiers
| CAS Number | 522652-58-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C(=S)SC(=N2)SCC(=O)NC3=NC=CS3 |
Product Overview
ChemDiv2_004569 (CAS 522652-58-0), with molecular formula C13H10N4OS4 and molecular weight 365.97 g/mol. IUPAC: 2-[(4-phenyl-5-sulfanylidene-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(1,3-thiazol-2-yl)acetamide.
Chemical Property Profile of ChemDiv2_004569
Property Insights of ChemDiv2_004569
The XLogP value of 3.85059 indicates that ChemDiv2_004569 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.81 Ų, ChemDiv2_004569 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv2_004569 has 1 hydrogen bond donor(s) and 7 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 ChemDiv2_004569?
The CAS number of ChemDiv2_004569 is 522652-58-0.
What is the molecular formula of ChemDiv2_004569?
The molecular formula of ChemDiv2_004569 is C13H10N4OS4.
What is the molecular weight of ChemDiv2_004569?
The molecular weight of ChemDiv2_004569 is 365.97 g/mol.
Where can I buy ChemDiv2_004569?
You can request a quote for ChemDiv2_004569 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv2_004569?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv2_004569 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.