1-(2-Chloroethyl)-3-methylbenzimidazol-2-imine
TL;DR: 1-(2-Chloroethyl)-3-methylbenzimidazol-2-imine (CAS 109753-33-5) is a chemical compound with molecular formula C10H12ClN3 and molecular weight 209.07198 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(2-chloroethyl)-3-methylbenzimidazol-2-imine
Also Known As: 1-(2-chloroethyl)-3-methylbenzimidazol-2-imine, 1-(2-chloroethyl)-3-methyl-benzoimidazol-2-imine, 2-Imino-1-methyl-3-(2-chloroethyl)benzimidazoline
Technical Specifications
| Molecular Formula | C10H12ClN3 |
| Molecular Weight | 209.07198 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 30.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 209.07198 Da |
| Heavy Atoms | 14 |
| Complexity | 231.0 |
| SMILES | CN1C2=CC=CC=C2N(C1=N)CCCl |
| InChIKey | GDDDMRKVIYUPLM-UHFFFAOYSA-N |
Chemical Property Profile of 1-(2-Chloroethyl)-3-methylbenzimidazol-2-imine
Property Insights of 1-(2-Chloroethyl)-3-methylbenzimidazol-2-imine
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2-Chloroethyl)-3-methylbenzimidazol-2-imine. With a topological polar surface area (TPSA) of 30.3 Ų, 1-(2-Chloroethyl)-3-methylbenzimidazol-2-imine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2-Chloroethyl)-3-methylbenzimidazol-2-imine has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-(2-Chloroethyl)-3-methylbenzimidazol-2-imine?
The CAS number of 1-(2-Chloroethyl)-3-methylbenzimidazol-2-imine is 109753-33-5.
What is the molecular formula of 1-(2-Chloroethyl)-3-methylbenzimidazol-2-imine?
The molecular formula of 1-(2-Chloroethyl)-3-methylbenzimidazol-2-imine is C10H12ClN3.
What is the molecular weight of 1-(2-Chloroethyl)-3-methylbenzimidazol-2-imine?
The molecular weight of 1-(2-Chloroethyl)-3-methylbenzimidazol-2-imine is 209.07198 g/mol.
Where can I buy 1-(2-Chloroethyl)-3-methylbenzimidazol-2-imine?
You can request a quote for 1-(2-Chloroethyl)-3-methylbenzimidazol-2-imine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(2-Chloroethyl)-3-methylbenzimidazol-2-imine?
Yes, CoreyChem provides custom synthesis services for 1-(2-Chloroethyl)-3-methylbenzimidazol-2-imine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.