RefChem:234814
TL;DR: RefChem:234814 (CAS 100037-03-4) is a chemical compound with molecular formula C22H28IN5O and molecular weight 505.13385 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[4-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]-3-(4-phenylpiperazin-1-yl)propan-1-one;hydroiodide
Also Known As: 4'-(2-Imidazolin-2-ylamino)-3-(4-phenyl-1-piperazinyl)propiophenone hydriodide, Propiophenone, 4'-(2-imidazolin-2-ylamino)-3-(4-phenyl-1-piperazinyl)-, monohydriodide, 1-Propanone, 1-(4-((4,5-dihydro-1H-imidazol-2-yl)amino)phenyl)-3-(4-phenyl-1-piperazinyl)-, monohydriodide, 1-[4-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]-3-(4-phenylpiperazin-1-yl)propan-1-one hydroiodide, 1-[4-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]-3-(4-phenylpiperazin-1-yl)propan-1-one,hydroiodide
Technical Specifications
| Molecular Formula | C22H28IN5O |
| Molecular Weight | 505.13385 g/mol |
| XLogP | 3.0707 |
| Topological Polar Surface Area (TPSA) | 60.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 505.13385 Da |
| Heavy Atoms | 29 |
| Complexity | 529.0 |
| SMILES | C1CN=C(N1)NC2=CC=C(C=C2)C(=O)CCN3CCN(CC3)C4=CC=CC=C4.I |
| InChIKey | PMBSHYXSYVBFET-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:234814
Property Insights of RefChem:234814
The XLogP value of 3.0707 indicates that RefChem:234814 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:234814. Following Lipinski's Rule of Five, RefChem:234814 has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of RefChem:234814?
The CAS number of RefChem:234814 is 100037-03-4.
What is the molecular formula of RefChem:234814?
The molecular formula of RefChem:234814 is C22H28IN5O.
What is the molecular weight of RefChem:234814?
The molecular weight of RefChem:234814 is 505.13385 g/mol.
Where can I buy RefChem:234814?
You can request a quote for RefChem:234814 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:234814?
Yes, CoreyChem provides custom synthesis services for RefChem:234814 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.