Ly 311727
TL;DR: Ly 311727 (CAS 164083-84-5) is a chemical compound with molecular formula C22H27N2O5P and molecular weight 430.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[3-(2-amino-2-oxoethyl)-1-benzyl-2-ethylindol-5-yl]oxypropylphosphonic acid
Also Known As: Ly 311727, (3-{[3-(2-Amino-2-Oxoethyl)-1-Benzyl-2-Ethyl-1h-Indol-5-Yl]oxy}propyl)phosphonic Acid, SID:76715713, LY311727, >=98% (HPLC), powder, 3-[3-(2-amino-2-oxoethyl)-1-benzyl-2-ethylindol-5-yl]oxypropylphosphonic acid
| Molecular Formula | C22H27N2O5P |
|---|---|
| Molecular Weight | 430.17 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 115.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 430.16577 |
| Heavy Atoms | 30 |
| Complexity | 606.0 |
Chemical Identifiers
| CAS Number | 164083-84-5 |
|---|---|
| SMILES | CCC1=C(C2=C(N1CC3=CC=CC=C3)C=CC(=C2)OCCCP(=O)(O)O)CC(=O)N |
| InChIKey | OPWQYOUZRHDKBR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ly 311727 (CAS 164083-84-5), with molecular formula C22H27N2O5P and molecular weight 430.17 g/mol. IUPAC: 3-[3-(2-amino-2-oxoethyl)-1-benzyl-2-ethylindol-5-yl]oxypropylphosphonic acid.
Chemical Property Profile of Ly 311727
Property Insights of Ly 311727
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ly 311727. The TPSA of 115.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Ly 311727. Following Lipinski's Rule of Five, Ly 311727 has 3 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 Ly 311727?
The CAS number of Ly 311727 is 164083-84-5.
What is the molecular formula of Ly 311727?
The molecular formula of Ly 311727 is C22H27N2O5P.
What is the molecular weight of Ly 311727?
The molecular weight of Ly 311727 is 430.17 g/mol.
Where can I buy Ly 311727?
You can request a quote for Ly 311727 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ly 311727?
Yes, KEHONG BIO provides custom synthesis services for Ly 311727 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.