2,1,3-Benzothia(S(sup IV))diazole-5-methylamine, N,N'-dithiobis(ethylene)bis-
TL;DR: 2,1,3-Benzothia(S(sup IV))diazole-5-methylamine, N,N'-dithiobis(ethylene)bis- (CAS 100333-42-4) is a chemical compound with molecular formula C18H20N6S4 and molecular weight 448.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,1,3-benzothiadiazol-5-ylmethyl)-2-[2-(2,1,3-benzothiadiazol-5-ylmethylamino)ethyldisulfanyl]ethanamine
Also Known As: 2,1,3-Benzothia(S(sup IV))diazole-5-methylamine, N,N'-dithiobis(ethylene)bis-, N,N'-Dithiobis(ethylene)bis(2,1,3-benzothia(S(sup IV))diazole-5-methylamine), N,N -(Dithiobisethylene)bis(2,1,3-benzothiadiazole-SIV-5-methanamine), 2,1,3-Benzothia(S(sup IV))diazole-5-methylamine,N,N'-dithiobis(ethylene)bis, 2,2'-Disulfanediylbis{N-[(2,1,3-benzothiadiazol-5-yl)methyl]ethan-1-amine}
| Molecular Formula | C18H20N6S4 |
|---|---|
| Molecular Weight | 448.06 g/mol |
| LogP | 3.9568 |
| Topological Polar Surface Area | 75.62 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 11 |
| Exact Mass | 448.06323 |
| Heavy Atoms | 28 |
| Complexity | 935.33844 |
Chemical Identifiers
| CAS Number | 100333-42-4 |
|---|---|
| SMILES | C1=CC2=NSN=C2C=C1CNCCSSCCNCC3=CC4=NSN=C4C=C3 |
Product Overview
2,1,3-Benzothia(S(sup IV))diazole-5-methylamine, N,N'-dithiobis(ethylene)bis- (CAS 100333-42-4), with molecular formula C18H20N6S4 and molecular weight 448.06 g/mol. IUPAC: N-(2,1,3-benzothiadiazol-5-ylmethyl)-2-[2-(2,1,3-benzothiadiazol-5-ylmethylamino)ethyldisulfanyl]ethanamine.
Chemical Property Profile of 2,1,3-Benzothia(S(sup IV))diazole-5-methylamine, N,N'-dithiobis(ethylene)bis-
Property Insights of 2,1,3-Benzothia(S(sup IV))diazole-5-methylamine, N,N'-dithiobis(ethylene)bis-
The XLogP value of 3.9568 indicates that 2,1,3-Benzothia(S(sup IV))diazole-5-methylamine, N,N'-dithiobis(ethylene)bis- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.62 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,1,3-Benzothia(S(sup IV))diazole-5-methylamine, N,N'-dithiobis(ethylene)bis-. Following Lipinski's Rule of Five, 2,1,3-Benzothia(S(sup IV))diazole-5-methylamine, N,N'-dithiobis(ethylene)bis- 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 2,1,3-Benzothia(S(sup IV))diazole-5-methylamine, N,N'-dithiobis(ethylene)bis-?
The CAS number of 2,1,3-Benzothia(S(sup IV))diazole-5-methylamine, N,N'-dithiobis(ethylene)bis- is 100333-42-4.
What is the molecular formula of 2,1,3-Benzothia(S(sup IV))diazole-5-methylamine, N,N'-dithiobis(ethylene)bis-?
The molecular formula of 2,1,3-Benzothia(S(sup IV))diazole-5-methylamine, N,N'-dithiobis(ethylene)bis- is C18H20N6S4.
What is the molecular weight of 2,1,3-Benzothia(S(sup IV))diazole-5-methylamine, N,N'-dithiobis(ethylene)bis-?
The molecular weight of 2,1,3-Benzothia(S(sup IV))diazole-5-methylamine, N,N'-dithiobis(ethylene)bis- is 448.06 g/mol.
Where can I buy 2,1,3-Benzothia(S(sup IV))diazole-5-methylamine, N,N'-dithiobis(ethylene)bis-?
You can request a quote for 2,1,3-Benzothia(S(sup IV))diazole-5-methylamine, N,N'-dithiobis(ethylene)bis- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,1,3-Benzothia(S(sup IV))diazole-5-methylamine, N,N'-dithiobis(ethylene)bis-?
Yes, KEHONG BIO provides custom synthesis services for 2,1,3-Benzothia(S(sup IV))diazole-5-methylamine, N,N'-dithiobis(ethylene)bis- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.