LY 88329
TL;DR: LY 88329 (CAS 78693-86-4) is a chemical compound with molecular formula C25H29NO6 and molecular weight 439.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-but-2-enedioic acid;3-[(3S,4S)-4-(3-hydroxyphenyl)-3-methylpiperidin-1-yl]-1-phenylpropan-1-one
Also Known As: LY 88329, 1-Propanone, 3-(4-(3-hydroxyphenyl)-3,4-dimethyl-1-piperidinyl)-1-phenyl-, cis-(+-)-, (Z)-2-butenedioate (1:1) (salt), (Z)-But-2-enedioic acid;3-[(3S,4S)-4-(3-hydroxyphenyl)-3-methylpiperidin-1-yl]-1-phenylpropan-1-one, (Z)-but-2-enedioic acid; 3-[(3S,4S)-4-(3-hydroxyphenyl)-3-methylpiperidin-1-yl]-1-phenylpropan-1-one
| Molecular Formula | C25H29NO6 |
|---|---|
| Molecular Weight | 439.20 g/mol |
| LogP | 3.8024 |
| Topological Polar Surface Area | 115.14 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 439.1995 |
| Heavy Atoms | 32 |
| Complexity | 924.4581 |
Chemical Identifiers
| CAS Number | 78693-86-4 |
|---|---|
| SMILES | C[C@@H]1CN(CC[C@@H]1C2=CC(=CC=C2)O)CCC(=O)C3=CC=CC=C3.C(=C\C(=O)O)\C(=O)O |
Product Overview
LY 88329 (CAS 78693-86-4), with molecular formula C25H29NO6 and molecular weight 439.20 g/mol. IUPAC: (Z)-but-2-enedioic acid;3-[(3S,4S)-4-(3-hydroxyphenyl)-3-methylpiperidin-1-yl]-1-phenylpropan-1-one.
Chemical Property Profile of LY 88329
Property Insights of LY 88329
The XLogP value of 3.8024 indicates that LY 88329 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 115.14 Ų falls within the moderate polarity range, balancing permeability and solubility for LY 88329. Following Lipinski's Rule of Five, LY 88329 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 88329?
The CAS number of LY 88329 is 78693-86-4.
What is the molecular formula of LY 88329?
The molecular formula of LY 88329 is C25H29NO6.
What is the molecular weight of LY 88329?
The molecular weight of LY 88329 is 439.20 g/mol.
Where can I buy LY 88329?
You can request a quote for LY 88329 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for LY 88329?
Yes, KEHONG BIO provides custom synthesis services for LY 88329 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.