![N,N'-[(nitroimino)bis(ethane-2,1-diyl-1,3,4-thiadiazol-2-yl-5-ylidene)]diacetamide structure](/static/products/672/672944-95-5.png)
N,N'-[(nitroimino)bis(ethane-2,1-diyl-1,3,4-thiadiazol-2-yl-5-ylidene)]diacetamide
TL;DR: N,N'-[(nitroimino)bis(ethane-2,1-diyl-1,3,4-thiadiazol-2-yl-5-ylidene)]diacetamide (CAS 672944-95-5) is a chemical compound with molecular formula C12H16N8O4S2 and molecular weight 400.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5-[2-[2-(5-acetamido-1,3,4-thiadiazol-2-yl)ethyl-nitroamino]ethyl]-1,3,4-thiadiazol-2-yl]acetamide
Also Known As: N,N'-[(nitroimino)bis(ethane-2,1-diyl-1,3,4-thiadiazol-2-yl-5-ylidene)]diacetamide, N,N'-(5,5'-((nitroazanediyl)bis(ethane-2,1-diyl))bis(1,3,4-thiadiazole-5,2-diyl))diacetamide, N-[5-[2-[2-(5-acetamido-1,3,4-thiadiazol-2-yl)ethyl-nitroamino]ethyl]-1,3,4-thiadiazol-2-yl]acetamide
| Molecular Formula | C12H16N8O4S2 |
|---|---|
| Molecular Weight | 400.07 g/mol |
| LogP | 0.5853 |
| Topological Polar Surface Area | 156.14 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 9 |
| Exact Mass | 400.0736 |
| Heavy Atoms | 26 |
| Complexity | 733.5471 |
Chemical Identifiers
| CAS Number | 672944-95-5 |
|---|---|
| SMILES | CC(=O)NC1=NN=C(S1)CCN(CCC2=NN=C(S2)NC(=O)C)[N+](=O)[O-] |
Product Overview
N,N'-[(nitroimino)bis(ethane-2,1-diyl-1,3,4-thiadiazol-2-yl-5-ylidene)]diacetamide (CAS 672944-95-5), with molecular formula C12H16N8O4S2 and molecular weight 400.07 g/mol. IUPAC: N-[5-[2-[2-(5-acetamido-1,3,4-thiadiazol-2-yl)ethyl-nitroamino]ethyl]-1,3,4-thiadiazol-2-yl]acetamide.
Chemical Property Profile of N,N'-[(nitroimino)bis(ethane-2,1-diyl-1,3,4-thiadiazol-2-yl-5-ylidene)]diacetamide
Property Insights of N,N'-[(nitroimino)bis(ethane-2,1-diyl-1,3,4-thiadiazol-2-yl-5-ylidene)]diacetamide
The XLogP value of 0.5853 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N'-[(nitroimino)bis(ethane-2,1-diyl-1,3,4-thiadiazol-2-yl-5-ylidene)]diacetamide. The TPSA of 156.14 Ų indicates high polarity, suggesting N,N'-[(nitroimino)bis(ethane-2,1-diyl-1,3,4-thiadiazol-2-yl-5-ylidene)]diacetamide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N,N'-[(nitroimino)bis(ethane-2,1-diyl-1,3,4-thiadiazol-2-yl-5-ylidene)]diacetamide has 2 hydrogen bond donor(s) and 10 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,N'-[(nitroimino)bis(ethane-2,1-diyl-1,3,4-thiadiazol-2-yl-5-ylidene)]diacetamide?
The CAS number of N,N'-[(nitroimino)bis(ethane-2,1-diyl-1,3,4-thiadiazol-2-yl-5-ylidene)]diacetamide is 672944-95-5.
What is the molecular formula of N,N'-[(nitroimino)bis(ethane-2,1-diyl-1,3,4-thiadiazol-2-yl-5-ylidene)]diacetamide?
The molecular formula of N,N'-[(nitroimino)bis(ethane-2,1-diyl-1,3,4-thiadiazol-2-yl-5-ylidene)]diacetamide is C12H16N8O4S2.
What is the molecular weight of N,N'-[(nitroimino)bis(ethane-2,1-diyl-1,3,4-thiadiazol-2-yl-5-ylidene)]diacetamide?
The molecular weight of N,N'-[(nitroimino)bis(ethane-2,1-diyl-1,3,4-thiadiazol-2-yl-5-ylidene)]diacetamide is 400.07 g/mol.
Where can I buy N,N'-[(nitroimino)bis(ethane-2,1-diyl-1,3,4-thiadiazol-2-yl-5-ylidene)]diacetamide?
You can request a quote for N,N'-[(nitroimino)bis(ethane-2,1-diyl-1,3,4-thiadiazol-2-yl-5-ylidene)]diacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N'-[(nitroimino)bis(ethane-2,1-diyl-1,3,4-thiadiazol-2-yl-5-ylidene)]diacetamide?
Yes, KEHONG BIO provides custom synthesis services for N,N'-[(nitroimino)bis(ethane-2,1-diyl-1,3,4-thiadiazol-2-yl-5-ylidene)]diacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.