capeserod
TL;DR: capeserod (CAS 769901-96-4) is a chemical compound with molecular formula C23H25ClN4O4 and molecular weight 456.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(5-amino-6-chloro-2,3-dihydro-1,4-benzodioxin-8-yl)-3-[1-(2-phenylethyl)piperidin-4-yl]-1,3,4-oxadiazol-2-one
Also Known As: capeserod, Capeserod [INN], capeserodum, Capeserod (free base), GTPL29
| Molecular Formula | C23H25ClN4O4 |
|---|---|
| Molecular Weight | 456.16 g/mol |
| LogP | 3.3897 |
| Topological Polar Surface Area | 95.75 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 456.15643 |
| Heavy Atoms | 32 |
| Complexity | 1152.7933 |
Chemical Identifiers
| CAS Number | 769901-96-4 |
|---|---|
| SMILES | C1CN(CCC1N2C(=O)OC(=N2)C3=CC(=C(C4=C3OCCO4)N)Cl)CCC5=CC=CC=C5 |
Product Overview
capeserod (CAS 769901-96-4), with molecular formula C23H25ClN4O4 and molecular weight 456.16 g/mol. IUPAC: 5-(5-amino-6-chloro-2,3-dihydro-1,4-benzodioxin-8-yl)-3-[1-(2-phenylethyl)piperidin-4-yl]-1,3,4-oxadiazol-2-one.
Chemical Property Profile of capeserod
Property Insights of capeserod
The XLogP value of 3.3897 indicates that capeserod is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.75 Ų falls within the moderate polarity range, balancing permeability and solubility for capeserod. Following Lipinski's Rule of Five, capeserod has 1 hydrogen bond donor(s) and 7 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 capeserod?
The CAS number of capeserod is 769901-96-4.
What is the molecular formula of capeserod?
The molecular formula of capeserod is C23H25ClN4O4.
What is the molecular weight of capeserod?
The molecular weight of capeserod is 456.16 g/mol.
Where can I buy capeserod?
You can request a quote for capeserod directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for capeserod?
Yes, KEHONG BIO provides custom synthesis services for capeserod and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.