Ips 339
TL;DR: Ips 339 (CAS 60979-28-4) is a chemical compound with molecular formula C20H25ClN2O2 and molecular weight 360.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(tert-butylamino)-3-(fluoren-9-ylideneamino)oxypropan-2-ol;hydrochloride
Also Known As: IPS 339, IPS339, IPS 339, monohydrochloride, (+-)-isomer, 9H-Fluoren-9-one, O-(3-((1,1-dimethylethyl)amino)-2-hydroxypropyl)oxime, monohydrochloride, SID:134224209
| Molecular Formula | C20H25ClN2O2 |
|---|---|
| Molecular Weight | 360.16 g/mol |
| LogP | 3.61 |
| Topological Polar Surface Area | 53.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 360.16046 |
| Heavy Atoms | 25 |
| Complexity | 419.0 |
Chemical Identifiers
| CAS Number | 60979-28-4 |
|---|---|
| SMILES | CC(C)(C)NCC(CON=C1C2=CC=CC=C2C3=CC=CC=C31)O.Cl |
| InChIKey | XGTCGZUATXJKQL-UHFFFAOYSA-N |
Product Overview
Ips 339 (CAS 60979-28-4), with molecular formula C20H25ClN2O2 and molecular weight 360.16 g/mol. IUPAC: 1-(tert-butylamino)-3-(fluoren-9-ylideneamino)oxypropan-2-ol;hydrochloride.
Chemical Property Profile of Ips 339
Property Insights of Ips 339
The XLogP value of 3.61 indicates that Ips 339 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.9 Ų, Ips 339 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ips 339 has 3 hydrogen bond donor(s) and 4 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 Ips 339?
The CAS number of Ips 339 is 60979-28-4.
What is the molecular formula of Ips 339?
The molecular formula of Ips 339 is C20H25ClN2O2.
What is the molecular weight of Ips 339?
The molecular weight of Ips 339 is 360.16 g/mol.
Where can I buy Ips 339?
You can request a quote for Ips 339 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ips 339?
Yes, KEHONG BIO provides custom synthesis services for Ips 339 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.