RefChem:246829
TL;DR: RefChem:246829 (CAS 98402-02-9) is a chemical compound with molecular formula C16H22ClN3O4 and molecular weight 355.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(4-methoxyphenyl)-5-methyl-3-(morpholin-4-ium-4-ylmethyl)imidazolidine-2,4-dione chloride
Also Known As: 3-(Morpholinomethyl)-5-(p-methoxyphenyl)-5-methylhydantoin hydrochloride, 2,4-Imidazolidinedione, 5-(4-methoxyphenyl)-5-methyl-3-(4-morpholinylmethyl)-, monohydrochloride, 2,4-IMIDAZOLIDINEDIONE, 5-(4-METHOXYPHENYL)-5-METHYL-3-(4-MORPHOLINYLMETHYL)-, M, 5-(4-methoxyphenyl)-5-methyl-3-(morpholin-4-ium-4-ylmethyl)imidazolidine-2,4-dione chloride, RefChem:246829
| Molecular Formula | C16H22ClN3O4 |
|---|---|
| Molecular Weight | 355.13 g/mol |
| LogP | -3.66 |
| Topological Polar Surface Area | 72.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 355.12988 |
| Heavy Atoms | 24 |
| Complexity | 458.0 |
Chemical Identifiers
| CAS Number | 98402-02-9 |
|---|---|
| SMILES | CC1(C(=O)N(C(=O)N1)C[NH+]2CCOCC2)C3=CC=C(C=C3)OC.[Cl-] |
| InChIKey | PRCCGPOXHBCNNA-UHFFFAOYSA-N |
Product Overview
RefChem:246829 (CAS 98402-02-9), with molecular formula C16H22ClN3O4 and molecular weight 355.13 g/mol. IUPAC: 5-(4-methoxyphenyl)-5-methyl-3-(morpholin-4-ium-4-ylmethyl)imidazolidine-2,4-dione chloride.
Chemical Property Profile of RefChem:246829
Property Insights of RefChem:246829
The XLogP value of -3.66 indicates that RefChem:246829 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 72.3 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:246829. Following Lipinski's Rule of Five, RefChem:246829 has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:246829?
The CAS number of RefChem:246829 is 98402-02-9.
What is the molecular formula of RefChem:246829?
The molecular formula of RefChem:246829 is C16H22ClN3O4.
What is the molecular weight of RefChem:246829?
The molecular weight of RefChem:246829 is 355.13 g/mol.
Where can I buy RefChem:246829?
You can request a quote for RefChem:246829 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:246829?
Yes, KEHONG BIO provides custom synthesis services for RefChem:246829 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.