TL;DR: n,n-Dimethyl[1,2,5]thiadiazolo[3,4-d]pyrimidin-7-amine (CAS 114865-66-6) is a chemical compound with molecular formula C6H7N5S and molecular weight 181.04222 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N,N-dimethyl-[1,2,5]thiadiazolo[3,4-d]pyrimidin-7-amine
Also Known As: n,n-dimethyl[1,2,5]thiadiazolo[3,4-d]pyrimidin-7-amine, N,N-dimethyl-[1,2,5]thiadiazolo[3,4-d]pyrimidin-7-amine
| Molecular Formula | C6H7N5S |
| Molecular Weight | 181.04222 g/mol |
| XLogP | 0.9 |
| Topological Polar Surface Area (TPSA) | 83.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 181.04222 Da |
| Heavy Atoms | 12 |
| Complexity | 164.0 |
| SMILES | CN(C)C1=NC=NC2=NSN=C21 |
| InChIKey | UWAXUHHASGYTBQ-UHFFFAOYSA-N |
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for n,n-Dimethyl[1,2,5]thiadiazolo[3,4-d]pyrimidin-7-amine. The TPSA of 83.0 Ų falls within the moderate polarity range, balancing permeability and solubility for n,n-Dimethyl[1,2,5]thiadiazolo[3,4-d]pyrimidin-7-amine. Following Lipinski's Rule of Five, n,n-Dimethyl[1,2,5]thiadiazolo[3,4-d]pyrimidin-7-amine has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of n,n-Dimethyl[1,2,5]thiadiazolo[3,4-d]pyrimidin-7-amine is 114865-66-6.
The molecular formula of n,n-Dimethyl[1,2,5]thiadiazolo[3,4-d]pyrimidin-7-amine is C6H7N5S.
The molecular weight of n,n-Dimethyl[1,2,5]thiadiazolo[3,4-d]pyrimidin-7-amine is 181.04222 g/mol.
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