Chileninone
TL;DR: Chileninone (CAS 95456-38-5) is a chemical compound with molecular formula C19H15NO4 and molecular weight 321.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-methoxy-17,19-dioxa-11-azapentacyclo[12.7.0.03,11.04,9.016,20]henicosa-1(21),2,4,6,9,14,16(20)-heptaen-8-one
Also Known As: Chileninone, 10-Methoxy-5,6-dihydro-2H,9H-[1,3]dioxolo[4,5-h]isoindolo[1,2-b][3]benzazepin-9-one, 3-Methoxy-7,8-dihydro-4H,11H-[1,3]dioxolo[4,5-h]isoindolo[1,2-b][3]benzazepin-4-one, 7-Methoxy-17,19-dioxa-11-azapentacyclo[12.7.0.03,11.04,9.016,20]henicosa-1(21),2,4,6,9,14,16(20)-heptaen-8-one
| Molecular Formula | C19H15NO4 |
|---|---|
| Molecular Weight | 321.10 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 48.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 321.1001 |
| Heavy Atoms | 24 |
| Complexity | 717.0 |
Chemical Identifiers
| CAS Number | 95456-38-5 |
|---|---|
| SMILES | COC1=CC=C2C3=CC4=CC5=C(C=C4CCN3C=C2C1=O)OCO5 |
| InChIKey | NDUSJMTZIOFAMG-UHFFFAOYSA-N |
Product Overview
Chileninone (CAS 95456-38-5), with molecular formula C19H15NO4 and molecular weight 321.10 g/mol. IUPAC: 7-methoxy-17,19-dioxa-11-azapentacyclo[12.7.0.03,11.04,9.016,20]henicosa-1(21),2,4,6,9,14,16(20)-heptaen-8-one.
Chemical Property Profile of Chileninone
Property Insights of Chileninone
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Chileninone. With a topological polar surface area (TPSA) of 48.0 Ų, Chileninone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Chileninone has 0 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 Chileninone?
The CAS number of Chileninone is 95456-38-5.
What is the molecular formula of Chileninone?
The molecular formula of Chileninone is C19H15NO4.
What is the molecular weight of Chileninone?
The molecular weight of Chileninone is 321.10 g/mol.
Where can I buy Chileninone?
You can request a quote for Chileninone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Chileninone?
Yes, KEHONG BIO provides custom synthesis services for Chileninone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.