RefChem:316285
TL;DR: RefChem:316285 (CAS 52073-17-3) is a chemical compound with molecular formula C20H29NO6 and molecular weight 379.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 6-methyl-2-[2-(2-morpholin-4-ylethoxy)-2-oxoethoxy]-3-propan-2-ylbenzoate
Also Known As: Acetic acid, (6-isopropyl-2-methoxycarbonyl-3-methylphenoxy)-, 2-morpholinoethyl ester, p-Cymene-2-carboxylic acid, 3-(2-(morpholino)ethoxycarbonylmethoxy)-, methyl ester, methyl 6-methyl-2-[2-(2-morpholin-4-ylethoxy)-2-oxoethoxy]-3-propan-2-ylbenzoate, methyl 6-methyl-2-{2-[2-(morpholin-4-yl)ethoxy]-2-oxoethoxy}-3-(propan-2-yl)benzoate, (6-Isopropyl -2-methoxycarbonyl -3-methylphenoxy)acetic acid 2-morpholinoethyl ester
| Molecular Formula | C20H29NO6 |
|---|---|
| Molecular Weight | 379.20 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 74.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 10 |
| Exact Mass | 379.1995 |
| Heavy Atoms | 27 |
| Complexity | 477.0 |
Chemical Identifiers
| CAS Number | 52073-17-3 |
|---|---|
| SMILES | CC1=C(C(=C(C=C1)C(C)C)OCC(=O)OCCN2CCOCC2)C(=O)OC |
| InChIKey | ISJYJYCUFQBHMN-UHFFFAOYSA-N |
Product Overview
RefChem:316285 (CAS 52073-17-3), with molecular formula C20H29NO6 and molecular weight 379.20 g/mol. IUPAC: methyl 6-methyl-2-[2-(2-morpholin-4-ylethoxy)-2-oxoethoxy]-3-propan-2-ylbenzoate.
Chemical Property Profile of RefChem:316285
Property Insights of RefChem:316285
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:316285. The TPSA of 74.3 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:316285. Following Lipinski's Rule of Five, RefChem:316285 has 0 hydrogen bond donor(s) and 7 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:316285?
The CAS number of RefChem:316285 is 52073-17-3.
What is the molecular formula of RefChem:316285?
The molecular formula of RefChem:316285 is C20H29NO6.
What is the molecular weight of RefChem:316285?
The molecular weight of RefChem:316285 is 379.20 g/mol.
Where can I buy RefChem:316285?
You can request a quote for RefChem:316285 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:316285?
Yes, KEHONG BIO provides custom synthesis services for RefChem:316285 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.