8-Hydroxyloxapine
TL;DR: 8-Hydroxyloxapine (CAS 61443-77-4) is a chemical compound with molecular formula C18H18ClN3O2 and molecular weight 343.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-chloro-6-(4-methylpiperazin-1-yl)benzo[b][1,4]benzoxazepin-3-ol
Also Known As: 8-Hydroxyloxapine, 8-Hydroxy Loxapine, 8-chloro-6-(4-methylpiperazin-1-yl)benzo[b][1,4]benzoxazepin-3-ol, SID:135653571, 2-Chloro-11-(4-methyl-1-piperazinyl)dibenz[b,f][1,4]oxazepin-8-ol
| Molecular Formula | C18H18ClN3O2 |
|---|---|
| Molecular Weight | 343.11 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 48.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 343.10876 |
| Heavy Atoms | 24 |
| Complexity | 481.0 |
Chemical Identifiers
| CAS Number | 61443-77-4 |
|---|---|
| SMILES | CN1CCN(CC1)C2=NC3=C(C=CC(=C3)O)OC4=C2C=C(C=C4)Cl |
| InChIKey | VNJRIWXLPIYFGI-UHFFFAOYSA-N |
Product Overview
8-Hydroxyloxapine (CAS 61443-77-4), with molecular formula C18H18ClN3O2 and molecular weight 343.11 g/mol. IUPAC: 8-chloro-6-(4-methylpiperazin-1-yl)benzo[b][1,4]benzoxazepin-3-ol.
Chemical Property Profile of 8-Hydroxyloxapine
Property Insights of 8-Hydroxyloxapine
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-Hydroxyloxapine. With a topological polar surface area (TPSA) of 48.3 Ų, 8-Hydroxyloxapine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8-Hydroxyloxapine has 1 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 8-Hydroxyloxapine?
The CAS number of 8-Hydroxyloxapine is 61443-77-4.
What is the molecular formula of 8-Hydroxyloxapine?
The molecular formula of 8-Hydroxyloxapine is C18H18ClN3O2.
What is the molecular weight of 8-Hydroxyloxapine?
The molecular weight of 8-Hydroxyloxapine is 343.11 g/mol.
Where can I buy 8-Hydroxyloxapine?
You can request a quote for 8-Hydroxyloxapine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-Hydroxyloxapine?
Yes, KEHONG BIO provides custom synthesis services for 8-Hydroxyloxapine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.