RefChem:332699
TL;DR: RefChem:332699 (CAS 100836-65-5) is a chemical compound with molecular formula C19H33ClN2O3 and molecular weight 372.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[1-(3,5-dimethylphenoxy)propan-2-yl-methylcarbamoyl]oxyethyl-diethylazanium chloride
Also Known As: C 2140, Carbamic acid, N-methyl-N-(1-(3,5-xylyloxy)-2-propyl)-, 2-(diethylamino)ethyl ester, hydrochloride, N-Methyl-N-(1-(3,5-xylyloxy)-2-propyl)carbamic acid, 2-(diethylamino)ethyl ester, HCl, 2-[1-(3,5-Dimethylphenoxy)propan-2-yl-methylcarbamoyl]oxyethyl-diethylazaniumchloride, 2-[1-(3,5-dimethylphenoxy)propan-2-yl-methylcarbamoyl]oxyethyl-diethylazanium
| Molecular Formula | C19H33ClN2O3 |
|---|---|
| Molecular Weight | 372.22 g/mol |
| LogP | -0.93 |
| Topological Polar Surface Area | 43.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 372.21796 |
| Heavy Atoms | 25 |
| Complexity | 351.0 |
Chemical Identifiers
| CAS Number | 100836-65-5 |
|---|---|
| SMILES | CC[NH+](CC)CCOC(=O)N(C)C(C)COC1=CC(=CC(=C1)C)C.[Cl-] |
| InChIKey | GEASIWHGUXJJJV-UHFFFAOYSA-N |
Product Overview
RefChem:332699 (CAS 100836-65-5), with molecular formula C19H33ClN2O3 and molecular weight 372.22 g/mol. IUPAC: 2-[1-(3,5-dimethylphenoxy)propan-2-yl-methylcarbamoyl]oxyethyl-diethylazanium chloride.
Chemical Property Profile of RefChem:332699
Property Insights of RefChem:332699
The XLogP value of -0.93 indicates that RefChem:332699 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 43.2 Ų, RefChem:332699 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:332699 has 1 hydrogen bond donor(s) and 4 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:332699?
The CAS number of RefChem:332699 is 100836-65-5.
What is the molecular formula of RefChem:332699?
The molecular formula of RefChem:332699 is C19H33ClN2O3.
What is the molecular weight of RefChem:332699?
The molecular weight of RefChem:332699 is 372.22 g/mol.
Where can I buy RefChem:332699?
You can request a quote for RefChem:332699 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:332699?
Yes, KEHONG BIO provides custom synthesis services for RefChem:332699 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.