4-(Dimethylamino)methylene-2,1,3-benzothiadiazole and methyl iodide
TL;DR: 4-(Dimethylamino)methylene-2,1,3-benzothiadiazole and methyl iodide (CAS 101398-45-2) is a chemical compound with molecular formula C10H13IN4S and molecular weight 347.99057 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N'-(2,1,3-benzothiadiazol-4-yl)-N,N-dimethylmethanimidamide;iodomethane
Also Known As: 4-(Dimethylamino)methylene-2,1,3-benzothiadiazole and methyl iodide, Formamidine, N'-(1,3-benzothiadiazol-4-yl)-N,N-dimethyl-, compd. with methyl iodine, N'-(2,1,3-benzothiadiazol-4-yl)-N,N-dimethyl-formamidine; iodomethane, N'-(2,1,3-benzothiadiazol-4-yl)-N,N-dimethylmethanimidamide; iodomethane, n'-2,1,3-benzothiadiazol-4-yl-n,n-dimethylimidoformamide- iodomethane(1:1)
Technical Specifications
| Molecular Formula | C10H13IN4S |
| Molecular Weight | 347.99057 g/mol |
| XLogP | 2.96 |
| Topological Polar Surface Area (TPSA) | 69.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 347.99057 Da |
| Heavy Atoms | 16 |
| Complexity | 221.0 |
| SMILES | CN(C)C=NC1=CC=CC2=NSN=C21.CI |
| InChIKey | KTBPRCFPZXZROS-UHFFFAOYSA-N |
Chemical Property Profile of 4-(Dimethylamino)methylene-2,1,3-benzothiadiazole and methyl iodide
Property Insights of 4-(Dimethylamino)methylene-2,1,3-benzothiadiazole and methyl iodide
The XLogP value of 2.96 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(Dimethylamino)methylene-2,1,3-benzothiadiazole and methyl iodide. The TPSA of 69.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(Dimethylamino)methylene-2,1,3-benzothiadiazole and methyl iodide. Following Lipinski's Rule of Five, 4-(Dimethylamino)methylene-2,1,3-benzothiadiazole and methyl iodide has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-(Dimethylamino)methylene-2,1,3-benzothiadiazole and methyl iodide?
The CAS number of 4-(Dimethylamino)methylene-2,1,3-benzothiadiazole and methyl iodide is 101398-45-2.
What is the molecular formula of 4-(Dimethylamino)methylene-2,1,3-benzothiadiazole and methyl iodide?
The molecular formula of 4-(Dimethylamino)methylene-2,1,3-benzothiadiazole and methyl iodide is C10H13IN4S.
What is the molecular weight of 4-(Dimethylamino)methylene-2,1,3-benzothiadiazole and methyl iodide?
The molecular weight of 4-(Dimethylamino)methylene-2,1,3-benzothiadiazole and methyl iodide is 347.99057 g/mol.
Where can I buy 4-(Dimethylamino)methylene-2,1,3-benzothiadiazole and methyl iodide?
You can request a quote for 4-(Dimethylamino)methylene-2,1,3-benzothiadiazole and methyl iodide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-(Dimethylamino)methylene-2,1,3-benzothiadiazole and methyl iodide?
Yes, CoreyChem provides custom synthesis services for 4-(Dimethylamino)methylene-2,1,3-benzothiadiazole and methyl iodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.