AB00685503-01
TL;DR: AB00685503-01 (CAS 682764-21-2) is a chemical compound with molecular formula C16H16N4O3S3 and molecular weight 408.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-[(5E)-5-(furan-2-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanamide
Also Known As: AB00685503-01, F1063-2056, N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-[(5E)-5-[(furan-2-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanamide, N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-[(5E)-5-(furan-2-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanamide, N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-[(5E)-5-(furan-2-ylmethylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanamide
| Molecular Formula | C16H16N4O3S3 |
|---|---|
| Molecular Weight | 408.04 g/mol |
| LogP | 3.3136 |
| Topological Polar Surface Area | 88.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 408.03845 |
| Heavy Atoms | 26 |
| Complexity | 844.80695 |
Chemical Identifiers
| CAS Number | 682764-21-2 |
|---|---|
| SMILES | CCC1=NN=C(S1)NC(=O)CCCN2C(=O)/C(=C\C3=CC=CO3)/SC2=S |
Product Overview
AB00685503-01 (CAS 682764-21-2), with molecular formula C16H16N4O3S3 and molecular weight 408.04 g/mol. IUPAC: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-[(5E)-5-(furan-2-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanamide.
Chemical Property Profile of AB00685503-01
Property Insights of AB00685503-01
The XLogP value of 3.3136 indicates that AB00685503-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.33 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00685503-01. Following Lipinski's Rule of Five, AB00685503-01 has 1 hydrogen bond donor(s) and 8 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 AB00685503-01?
The CAS number of AB00685503-01 is 682764-21-2.
What is the molecular formula of AB00685503-01?
The molecular formula of AB00685503-01 is C16H16N4O3S3.
What is the molecular weight of AB00685503-01?
The molecular weight of AB00685503-01 is 408.04 g/mol.
Where can I buy AB00685503-01?
You can request a quote for AB00685503-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00685503-01?
Yes, KEHONG BIO provides custom synthesis services for AB00685503-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.