(+)-Etodolac
TL;DR: (+)-Etodolac (CAS 87249-11-4) is a chemical compound with molecular formula C17H21NO3 and molecular weight 287.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(1S)-1,8-diethyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]acetic acid
Also Known As: (S)-etodolac, (+)-etodolac, (S)-(+)-etodolac, etodolac, Etodolac, (S)-
| Molecular Formula | C17H21NO3 |
|---|---|
| Molecular Weight | 287.15 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 62.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 287.15213 |
| Heavy Atoms | 21 |
| Complexity | 399.0 |
Chemical Identifiers
| CAS Number | 87249-11-4 |
|---|---|
| SMILES | CCC1=C2C(=CC=C1)C3=C(N2)[C@](OCC3)(CC)CC(=O)O |
| InChIKey | NNYBQONXHNTVIJ-KRWDZBQOSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(+)-Etodolac (CAS 87249-11-4), with molecular formula C17H21NO3 and molecular weight 287.15 g/mol. IUPAC: 2-[(1S)-1,8-diethyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl]acetic acid.
Chemical Property Profile of (+)-Etodolac
Property Insights of (+)-Etodolac
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (+)-Etodolac. The TPSA of 62.3 Ų falls within the moderate polarity range, balancing permeability and solubility for (+)-Etodolac. Following Lipinski's Rule of Five, (+)-Etodolac has 2 hydrogen bond donor(s) and 3 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 (+)-Etodolac?
The CAS number of (+)-Etodolac is 87249-11-4.
What is the molecular formula of (+)-Etodolac?
The molecular formula of (+)-Etodolac is C17H21NO3.
What is the molecular weight of (+)-Etodolac?
The molecular weight of (+)-Etodolac is 287.15 g/mol.
Where can I buy (+)-Etodolac?
You can request a quote for (+)-Etodolac directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (+)-Etodolac?
Yes, KEHONG BIO provides custom synthesis services for (+)-Etodolac and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.