R 76186
TL;DR: R 76186 (CAS 122866-79-9) is a chemical compound with molecular formula C25H40ClN5O4 and molecular weight 509.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-amino-5-chloro-N-[(3S,4R)-1-[4-[4-(dimethylamino)piperidin-1-yl]-4-oxobutyl]-3-methoxypiperidin-4-yl]-2-methoxybenzamide
Also Known As: PDSP1_001619, PDSP2_001603, R 76186, R-76186, J1.158.496I
| Molecular Formula | C25H40ClN5O4 |
|---|---|
| Molecular Weight | 509.28 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 100.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 509.2769 |
| Heavy Atoms | 35 |
| Complexity | 691.0 |
Chemical Identifiers
| CAS Number | 122866-79-9 |
|---|---|
| SMILES | CN(C)C1CCN(CC1)C(=O)CCCN2CC[C@H]([C@H](C2)OC)NC(=O)C3=CC(=C(C=C3OC)N)Cl |
| InChIKey | YEXQFGBCXUNVRL-GGAORHGYSA-N |
Product Overview
R 76186 (CAS 122866-79-9), with molecular formula C25H40ClN5O4 and molecular weight 509.28 g/mol. IUPAC: 4-amino-5-chloro-N-[(3S,4R)-1-[4-[4-(dimethylamino)piperidin-1-yl]-4-oxobutyl]-3-methoxypiperidin-4-yl]-2-methoxybenzamide.
Chemical Property Profile of R 76186
Property Insights of R 76186
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for R 76186. The TPSA of 100.0 Ų falls within the moderate polarity range, balancing permeability and solubility for R 76186. Following Lipinski's Rule of Five, R 76186 has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of R 76186?
The CAS number of R 76186 is 122866-79-9.
What is the molecular formula of R 76186?
The molecular formula of R 76186 is C25H40ClN5O4.
What is the molecular weight of R 76186?
The molecular weight of R 76186 is 509.28 g/mol.
Where can I buy R 76186?
You can request a quote for R 76186 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for R 76186?
Yes, KEHONG BIO provides custom synthesis services for R 76186 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.