TL;DR: 4H-1,2,4-Triazino(5,6-b)indol-3-amine, 6-chloro-N,N,4-trimethyl- (CAS 122458-82-6) is a chemical compound with molecular formula C12H12ClN5 and molecular weight 261.07812 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-chloro-N,N,4-trimethyl-[1,2,4]triazino[5,6-b]indol-3-amine
Also Known As: 4H-1,2,4-Triazino(5,6-b)indol-3-amine, 6-chloro-N,N,4-trimethyl-, 6-chloro-n,n,4-trimethyl-4h-[1,2,4]triazino[5,6-b]indol-3-amine, 6-chloro-N,N,4-trimethyl-[1,2,4]triazino[5,6-b]indol-3-amine, 4H-1,2,4-Triazino[5,6-b]indol-3-amine, 6-chloro-N,N,4-trimethyl-, 4H-1,2,4-Triazino[5,6-b]indol-3-amine,6-chloro-N,N,4-trimethyl
| Molecular Formula | C12H12ClN5 |
| Molecular Weight | 261.07812 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 46.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 261.07812 Da |
| Heavy Atoms | 18 |
| Complexity | 313.0 |
| SMILES | CN1C2=NC3=C(C2=NN=C1N(C)C)C=CC=C3Cl |
| InChIKey | MKLCKTPMQZUAGJ-UHFFFAOYSA-N |
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4H-1,2,4-Triazino(5,6-b)indol-3-amine, 6-chloro-N,N,4-trimethyl-. With a topological polar surface area (TPSA) of 46.8 Ų, 4H-1,2,4-Triazino(5,6-b)indol-3-amine, 6-chloro-N,N,4-trimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4H-1,2,4-Triazino(5,6-b)indol-3-amine, 6-chloro-N,N,4-trimethyl- has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 4H-1,2,4-Triazino(5,6-b)indol-3-amine, 6-chloro-N,N,4-trimethyl- is 122458-82-6.
The molecular formula of 4H-1,2,4-Triazino(5,6-b)indol-3-amine, 6-chloro-N,N,4-trimethyl- is C12H12ClN5.
The molecular weight of 4H-1,2,4-Triazino(5,6-b)indol-3-amine, 6-chloro-N,N,4-trimethyl- is 261.07812 g/mol.
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