N,N'-[Dodecane-1,12-diylbis(sulfanediyl-1,3,4-thiadiazole-5,2-diyl)]dipropanamide
TL;DR: N,N'-[Dodecane-1,12-diylbis(sulfanediyl-1,3,4-thiadiazole-5,2-diyl)]dipropanamide (CAS 87202-68-4) is a chemical compound with molecular formula C22H36N6O2S4 and molecular weight 544.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5-[12-[[5-(propanoylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]dodecylsulfanyl]-1,3,4-thiadiazol-2-yl]propanamide
Also Known As: N,N'-[Dodecane-1,12-diylbis(sulfanediyl-1,3,4-thiadiazole-5,2-diyl)]dipropanamide, N-[5-[12-[[5-(propanoylamino)-1,3,4-thiadiazol-2-yl]sulfanyl, N-[5-[12-[[5-(propanoylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]dodecylsulfanyl]-1,3,4-thiadiazol-2-yl]propanamide
| Molecular Formula | C22H36N6O2S4 |
|---|---|
| Molecular Weight | 544.18 g/mol |
| LogP | 6.8 |
| Topological Polar Surface Area | 217.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 19 |
| Exact Mass | 544.1783 |
| Heavy Atoms | 34 |
| Complexity | 530.0 |
Chemical Identifiers
| CAS Number | 87202-68-4 |
|---|---|
| SMILES | CCC(=O)NC1=NN=C(S1)SCCCCCCCCCCCCSC2=NN=C(S2)NC(=O)CC |
| InChIKey | HVTQNWMELABCMH-UHFFFAOYSA-N |
Product Overview
N,N'-[Dodecane-1,12-diylbis(sulfanediyl-1,3,4-thiadiazole-5,2-diyl)]dipropanamide (CAS 87202-68-4), with molecular formula C22H36N6O2S4 and molecular weight 544.18 g/mol. IUPAC: N-[5-[12-[[5-(propanoylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]dodecylsulfanyl]-1,3,4-thiadiazol-2-yl]propanamide.
Chemical Property Profile of N,N'-[Dodecane-1,12-diylbis(sulfanediyl-1,3,4-thiadiazole-5,2-diyl)]dipropanamide
Property Insights of N,N'-[Dodecane-1,12-diylbis(sulfanediyl-1,3,4-thiadiazole-5,2-diyl)]dipropanamide
The XLogP value of 6.8 indicates that N,N'-[Dodecane-1,12-diylbis(sulfanediyl-1,3,4-thiadiazole-5,2-diyl)]dipropanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 217.0 Ų indicates high polarity, suggesting N,N'-[Dodecane-1,12-diylbis(sulfanediyl-1,3,4-thiadiazole-5,2-diyl)]dipropanamide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N,N'-[Dodecane-1,12-diylbis(sulfanediyl-1,3,4-thiadiazole-5,2-diyl)]dipropanamide has 2 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N,N'-[Dodecane-1,12-diylbis(sulfanediyl-1,3,4-thiadiazole-5,2-diyl)]dipropanamide?
The CAS number of N,N'-[Dodecane-1,12-diylbis(sulfanediyl-1,3,4-thiadiazole-5,2-diyl)]dipropanamide is 87202-68-4.
What is the molecular formula of N,N'-[Dodecane-1,12-diylbis(sulfanediyl-1,3,4-thiadiazole-5,2-diyl)]dipropanamide?
The molecular formula of N,N'-[Dodecane-1,12-diylbis(sulfanediyl-1,3,4-thiadiazole-5,2-diyl)]dipropanamide is C22H36N6O2S4.
What is the molecular weight of N,N'-[Dodecane-1,12-diylbis(sulfanediyl-1,3,4-thiadiazole-5,2-diyl)]dipropanamide?
The molecular weight of N,N'-[Dodecane-1,12-diylbis(sulfanediyl-1,3,4-thiadiazole-5,2-diyl)]dipropanamide is 544.18 g/mol.
Where can I buy N,N'-[Dodecane-1,12-diylbis(sulfanediyl-1,3,4-thiadiazole-5,2-diyl)]dipropanamide?
You can request a quote for N,N'-[Dodecane-1,12-diylbis(sulfanediyl-1,3,4-thiadiazole-5,2-diyl)]dipropanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N'-[Dodecane-1,12-diylbis(sulfanediyl-1,3,4-thiadiazole-5,2-diyl)]dipropanamide?
Yes, KEHONG BIO provides custom synthesis services for N,N'-[Dodecane-1,12-diylbis(sulfanediyl-1,3,4-thiadiazole-5,2-diyl)]dipropanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.