RefChem:249445
TL;DR: RefChem:249445 (CAS 24075-61-4) is a chemical compound with molecular formula C10H11N3O3S4 and molecular weight 348.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-(3-ethyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)-4-methyl-1,3,4-thiadiazol-2-yl]sulfanyl]acetic acid
Also Known As: [[5-4,5-dihydro-4-methyl-1,3,4-thiadiazol-2-yl]thio]aceticacid|2-[[5-(3-Ethyl-4-oxo-2-thioxo-5-thiazolidinylidene)-4,5-dihydro-4-methyl-1,3,4-thiadiazol-2-yl]thio]acetic acid|{[5-(3-ethyl-4-oxo-2-thioxothiazolidin-5-ylidene)-4,5-dihydro-4-methyl-1,3,4-thiadiazol-2-yl]thio}acetic acid|2-((5-(3-Ethyl-4-oxo-2-thioxo-5-thiazolidinylidene)-4,5-dihydro-4-methyl-1,3,4-thiadiazol-2-yl)thio)acetic acid|2-[[(5E)-5-(3-ethyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)-4-methyl-1,3,4-thiadiazol-2-yl]sulfanyl]acetic acid|2-[[(5Z)-5-(3-ethyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)-4-methyl-1,3,4-thiadiazol-2-yl]sulfanyl]acetic acid|RefChem:249445
| Molecular Formula | C10H11N3O3S4 |
|---|---|
| Molecular Weight | 348.97 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 181.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 4 |
| Exact Mass | 348.96832 |
| Heavy Atoms | 20 |
| Complexity | 546.0 |
Chemical Identifiers
| CAS Number | 24075-61-4 |
|---|---|
| SMILES | CCN1C(=O)C(=C2N(N=C(S2)SCC(=O)O)C)SC1=S |
| InChIKey | DZTXQVVJWODIAX-UHFFFAOYSA-N |
Product Overview
RefChem:249445 (CAS 24075-61-4), with molecular formula C10H11N3O3S4 and molecular weight 348.97 g/mol. IUPAC: 2-[[5-(3-ethyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)-4-methyl-1,3,4-thiadiazol-2-yl]sulfanyl]acetic acid.
Chemical Property Profile of RefChem:249445
Property Insights of RefChem:249445
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:249445. The TPSA of 181.0 Ų indicates high polarity, suggesting RefChem:249445 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:249445 has 1 hydrogen bond donor(s) and 9 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 RefChem:249445?
The CAS number of RefChem:249445 is 24075-61-4.
What is the molecular formula of RefChem:249445?
The molecular formula of RefChem:249445 is C10H11N3O3S4.
What is the molecular weight of RefChem:249445?
The molecular weight of RefChem:249445 is 348.97 g/mol.
Where can I buy RefChem:249445?
You can request a quote for RefChem:249445 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:249445?
Yes, KEHONG BIO provides custom synthesis services for RefChem:249445 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.