RefChem:234814
TL;DR: RefChem:234814 (CAS 100037-03-4) is a chemical compound with molecular formula C22H28IN5O and molecular weight 505.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
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
| Molecular Formula | C22H28IN5O |
|---|---|
| Molecular Weight | 505.13 g/mol |
| LogP | 3.0707 |
| Topological Polar Surface Area | 59.97 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 505.13385 |
| Heavy Atoms | 29 |
| Complexity | 816.8561 |
Chemical Identifiers
| CAS Number | 100037-03-4 |
|---|---|
| SMILES | C1CN=C(N1)NC2=CC=C(C=C2)C(=O)CCN3CCN(CC3)C4=CC=CC=C4.I |
Product Overview
RefChem:234814 (CAS 100037-03-4), with molecular formula C22H28IN5O and molecular weight 505.13 g/mol. IUPAC: 1-[4-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]-3-(4-phenylpiperazin-1-yl)propan-1-one;hydroiodide.
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. With a topological polar surface area (TPSA) of 59.97 Ų, RefChem:234814 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:234814 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
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 505.13 g/mol.
Where can I buy RefChem:234814?
You can request a quote for RefChem:234814 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:234814?
Yes, KEHONG BIO provides custom synthesis services for RefChem:234814 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.