Methyl 4-amnio etodolac
TL;DR: Methyl 4-amnio etodolac (CAS 111478-81-0) is a chemical compound with molecular formula C18H24N2O3 and molecular weight 316.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-(4-amino-1,8-diethyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl)acetate
Also Known As: Methyl 4-amnio etodolac, 4-aminoetodolac methyl ester, 4-AMINO-1,8-DIETHYL-1,3,4,9-TETRAHYDROPYRANO[3,4-B]INDOLE-1-ACETIC ACID METHYL ESTER, 4-Amino-1,8-diethyl-1,3,4,9-tetrahydropyrano[3,4- b]indole-1-acetic Acid Methyl Ester, Methyl (4-amino-1,8-diethyl-1,3,4,9-tetrahydropyrano[3,4-b]indol-1-yl)acetate
| Molecular Formula | C18H24N2O3 |
|---|---|
| Molecular Weight | 316.18 g/mol |
| LogP | 2.9287 |
| Topological Polar Surface Area | 77.34 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 316.17868 |
| Heavy Atoms | 23 |
| Complexity | 737.1871 |
Chemical Identifiers
| CAS Number | 111478-81-0 |
|---|---|
| SMILES | CCC1=C2C(=CC=C1)C3=C(N2)C(OCC3N)(CC)CC(=O)OC |
Product Overview
Methyl 4-amnio etodolac (CAS 111478-81-0), with molecular formula C18H24N2O3 and molecular weight 316.18 g/mol. IUPAC: methyl 2-(4-amino-1,8-diethyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl)acetate.
Chemical Property Profile of Methyl 4-amnio etodolac
Property Insights of Methyl 4-amnio etodolac
The XLogP value of 2.9287 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 4-amnio etodolac. The TPSA of 77.34 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 4-amnio etodolac. Following Lipinski's Rule of Five, Methyl 4-amnio etodolac has 2 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 Methyl 4-amnio etodolac?
The CAS number of Methyl 4-amnio etodolac is 111478-81-0.
What is the molecular formula of Methyl 4-amnio etodolac?
The molecular formula of Methyl 4-amnio etodolac is C18H24N2O3.
What is the molecular weight of Methyl 4-amnio etodolac?
The molecular weight of Methyl 4-amnio etodolac is 316.18 g/mol.
Where can I buy Methyl 4-amnio etodolac?
You can request a quote for Methyl 4-amnio etodolac directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 4-amnio etodolac?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4-amnio etodolac and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.