N-(2-chloroethyl)-1-propylbenzimidazol-2-amine
TL;DR: N-(2-chloroethyl)-1-propylbenzimidazol-2-amine (CAS 111678-93-4) is a chemical compound with molecular formula C12H16ClN3 and molecular weight 237.10327 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(2-chloroethyl)-1-propylbenzimidazol-2-amine
Also Known As: N-(2-chloroethyl)-1-propylbenzimidazol-2-amine, N-(2-chloroethyl)-1-propyl-benzoimidazol-2-amine, N-(2-chloroethyl)-1-propyl-1H-benzo[d]imidazol-2-amine
Technical Specifications
| Molecular Formula | C12H16ClN3 |
| Molecular Weight | 237.10327 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 29.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 237.10327 Da |
| Heavy Atoms | 16 |
| Complexity | 212.0 |
| SMILES | CCCN1C2=CC=CC=C2N=C1NCCCl |
| InChIKey | KKTQMWJIPVTYIM-UHFFFAOYSA-N |
Chemical Property Profile of N-(2-chloroethyl)-1-propylbenzimidazol-2-amine
Property Insights of N-(2-chloroethyl)-1-propylbenzimidazol-2-amine
The XLogP value of 3.2 indicates that N-(2-chloroethyl)-1-propylbenzimidazol-2-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.9 Ų, N-(2-chloroethyl)-1-propylbenzimidazol-2-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2-chloroethyl)-1-propylbenzimidazol-2-amine has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of N-(2-chloroethyl)-1-propylbenzimidazol-2-amine?
The CAS number of N-(2-chloroethyl)-1-propylbenzimidazol-2-amine is 111678-93-4.
What is the molecular formula of N-(2-chloroethyl)-1-propylbenzimidazol-2-amine?
The molecular formula of N-(2-chloroethyl)-1-propylbenzimidazol-2-amine is C12H16ClN3.
What is the molecular weight of N-(2-chloroethyl)-1-propylbenzimidazol-2-amine?
The molecular weight of N-(2-chloroethyl)-1-propylbenzimidazol-2-amine is 237.10327 g/mol.
Where can I buy N-(2-chloroethyl)-1-propylbenzimidazol-2-amine?
You can request a quote for N-(2-chloroethyl)-1-propylbenzimidazol-2-amine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-(2-chloroethyl)-1-propylbenzimidazol-2-amine?
Yes, CoreyChem provides custom synthesis services for N-(2-chloroethyl)-1-propylbenzimidazol-2-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.