RefChem:367659
TL;DR: RefChem:367659 (CAS 53206-92-1) is a chemical compound with molecular formula C21H34N2O4 and molecular weight 378.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[2-[3-(diethylamino)propylamino]-2-oxoethoxy]-6-methyl-3-propan-2-ylbenzoate
Also Known As: p-Cymene-2-carboxylic acid, 3-(3-(diethylamino)propylcarbamoylmethoxy)-, methyl ester, Methyl 3-(3-(diethylamino)propylcarbamoylmethoxy)-p-cymene-2-carboxylate, methyl 2-[2-[3-(diethylamino)propylamino]-2-oxoethoxy]-6-methyl-3-propan-2-ylbenzoate, 3-[3-(Diethylamino)propylcarbamoylmethoxy]-p-cymene-2-carboxylic acid methyl ester, methyl 2-({[3-(diethylamino)propyl]carbamoyl}methoxy)-6-methyl-3-(propan-2-yl)benzoate
| Molecular Formula | C21H34N2O4 |
|---|---|
| Molecular Weight | 378.25 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 67.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 12 |
| Exact Mass | 378.25186 |
| Heavy Atoms | 27 |
| Complexity | 451.0 |
Chemical Identifiers
| CAS Number | 53206-92-1 |
|---|---|
| SMILES | CCN(CC)CCCNC(=O)COC1=C(C=CC(=C1C(=O)OC)C)C(C)C |
| InChIKey | OWYSYUPPDPNMPG-UHFFFAOYSA-N |
Product Overview
RefChem:367659 (CAS 53206-92-1), with molecular formula C21H34N2O4 and molecular weight 378.25 g/mol. IUPAC: methyl 2-[2-[3-(diethylamino)propylamino]-2-oxoethoxy]-6-methyl-3-propan-2-ylbenzoate.
Chemical Property Profile of RefChem:367659
Property Insights of RefChem:367659
The XLogP value of 3.7 indicates that RefChem:367659 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.9 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:367659. Following Lipinski's Rule of Five, RefChem:367659 has 1 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:367659?
The CAS number of RefChem:367659 is 53206-92-1.
What is the molecular formula of RefChem:367659?
The molecular formula of RefChem:367659 is C21H34N2O4.
What is the molecular weight of RefChem:367659?
The molecular weight of RefChem:367659 is 378.25 g/mol.
Where can I buy RefChem:367659?
You can request a quote for RefChem:367659 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:367659?
Yes, KEHONG BIO provides custom synthesis services for RefChem:367659 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.