PMS 847
TL;DR: PMS 847 (CAS 162510-35-2) is a chemical compound with molecular formula C13H26N4 and molecular weight 238.21574 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(4,5-dihydro-1H-imidazol-2-yl)-1,4-di(propan-2-yl)piperazine
Also Known As: PMS 847, J1.109.622K, 1,4-Diisopropyl-2-(2-imidazoline-2-yl)piperazine, 1,4-diisopropyl-2-(4,5-dihydro[1H]imidazol-2-yl)piperazine, 2-(4,5-dihydro-1H-imidazol-2-yl)-1,4-bis(propan-2-yl)piperazine
Technical Specifications
| Molecular Formula | C13H26N4 |
| Molecular Weight | 238.21574 g/mol |
| XLogP | 0.7 |
| Topological Polar Surface Area (TPSA) | 30.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 238.21574 Da |
| Heavy Atoms | 17 |
| Complexity | 285.0 |
| SMILES | CC(C)N1CCN(C(C1)C2=NCCN2)C(C)C |
| InChIKey | UBLHYKNVKKEDSV-UHFFFAOYSA-N |
Chemical Property Profile of PMS 847
Property Insights of PMS 847
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for PMS 847. With a topological polar surface area (TPSA) of 30.9 Ų, PMS 847 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, PMS 847 has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of PMS 847?
The CAS number of PMS 847 is 162510-35-2.
What is the molecular formula of PMS 847?
The molecular formula of PMS 847 is C13H26N4.
What is the molecular weight of PMS 847?
The molecular weight of PMS 847 is 238.21574 g/mol.
Where can I buy PMS 847?
You can request a quote for PMS 847 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for PMS 847?
Yes, CoreyChem provides custom synthesis services for PMS 847 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.