![N-cyclooctyl-N'-[(2Z)-5-ethyl-1,3,4-thiadiazol-2(3H)-ylidene]butanediamide structure](/static/products/713/713091-89-5.png)
N-cyclooctyl-N'-[(2Z)-5-ethyl-1,3,4-thiadiazol-2(3H)-ylidene]butanediamide
TL;DR: N-cyclooctyl-N'-[(2Z)-5-ethyl-1,3,4-thiadiazol-2(3H)-ylidene]butanediamide (CAS 713091-89-5) is a chemical compound with molecular formula C16H26N4O2S and molecular weight 338.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-cyclooctyl-N'-(5-ethyl-1,3,4-thiadiazol-2-yl)butanediamide
Also Known As: N-cyclooctyl-N'-(5-ethyl-1,3,4-thiadiazol-2-yl)butanediamide, N1-cyclooctyl-N4-(5-ethyl-1,3,4-thiadiazol-2-yl)succinamide, N-cyclooctyl-N'-[(2Z)-5-ethyl-1,3,4-thiadiazol-2(3H)-ylidene]butanediamide
| Molecular Formula | C16H26N4O2S |
|---|---|
| Molecular Weight | 338.18 g/mol |
| LogP | 3.0483 |
| Topological Polar Surface Area | 83.98 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 338.17764 |
| Heavy Atoms | 23 |
| Complexity | 509.93344 |
Chemical Identifiers
| CAS Number | 713091-89-5 |
|---|---|
| SMILES | CCC1=NN=C(S1)NC(=O)CCC(=O)NC2CCCCCCC2 |
Product Overview
N-cyclooctyl-N'-[(2Z)-5-ethyl-1,3,4-thiadiazol-2(3H)-ylidene]butanediamide (CAS 713091-89-5), with molecular formula C16H26N4O2S and molecular weight 338.18 g/mol. IUPAC: N-cyclooctyl-N'-(5-ethyl-1,3,4-thiadiazol-2-yl)butanediamide.
Chemical Property Profile of N-cyclooctyl-N'-[(2Z)-5-ethyl-1,3,4-thiadiazol-2(3H)-ylidene]butanediamide
Property Insights of N-cyclooctyl-N'-[(2Z)-5-ethyl-1,3,4-thiadiazol-2(3H)-ylidene]butanediamide
The XLogP value of 3.0483 indicates that N-cyclooctyl-N'-[(2Z)-5-ethyl-1,3,4-thiadiazol-2(3H)-ylidene]butanediamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.98 Ų falls within the moderate polarity range, balancing permeability and solubility for N-cyclooctyl-N'-[(2Z)-5-ethyl-1,3,4-thiadiazol-2(3H)-ylidene]butanediamide. Following Lipinski's Rule of Five, N-cyclooctyl-N'-[(2Z)-5-ethyl-1,3,4-thiadiazol-2(3H)-ylidene]butanediamide has 2 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 N-cyclooctyl-N'-[(2Z)-5-ethyl-1,3,4-thiadiazol-2(3H)-ylidene]butanediamide?
The CAS number of N-cyclooctyl-N'-[(2Z)-5-ethyl-1,3,4-thiadiazol-2(3H)-ylidene]butanediamide is 713091-89-5.
What is the molecular formula of N-cyclooctyl-N'-[(2Z)-5-ethyl-1,3,4-thiadiazol-2(3H)-ylidene]butanediamide?
The molecular formula of N-cyclooctyl-N'-[(2Z)-5-ethyl-1,3,4-thiadiazol-2(3H)-ylidene]butanediamide is C16H26N4O2S.
What is the molecular weight of N-cyclooctyl-N'-[(2Z)-5-ethyl-1,3,4-thiadiazol-2(3H)-ylidene]butanediamide?
The molecular weight of N-cyclooctyl-N'-[(2Z)-5-ethyl-1,3,4-thiadiazol-2(3H)-ylidene]butanediamide is 338.18 g/mol.
Where can I buy N-cyclooctyl-N'-[(2Z)-5-ethyl-1,3,4-thiadiazol-2(3H)-ylidene]butanediamide?
You can request a quote for N-cyclooctyl-N'-[(2Z)-5-ethyl-1,3,4-thiadiazol-2(3H)-ylidene]butanediamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-cyclooctyl-N'-[(2Z)-5-ethyl-1,3,4-thiadiazol-2(3H)-ylidene]butanediamide?
Yes, KEHONG BIO provides custom synthesis services for N-cyclooctyl-N'-[(2Z)-5-ethyl-1,3,4-thiadiazol-2(3H)-ylidene]butanediamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.