![8-Bromo-4-piperidin-1-ylpyrimido[4,5-b][1,4]benzoxazepine structure](/static/products/847/84762-66-3.png)
8-Bromo-4-piperidin-1-ylpyrimido[4,5-b][1,4]benzoxazepine
TL;DR: 8-Bromo-4-piperidin-1-ylpyrimido[4,5-b][1,4]benzoxazepine (CAS 84762-66-3) is a chemical compound with molecular formula C16H15BrN4O and molecular weight 358.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-bromo-4-piperidin-1-ylpyrimido[4,5-b][1,4]benzoxazepine
Also Known As: AH-262/08501041, 8-bromo-4-piperidin-1-ylpyrimido[4,5-b][1,4]benzoxazepine, 8-bromo-4-piperidino-pyrimido[4,5-b][1,4]benzoxazepine, 8-bromo-4-(1-piperidinyl)pyrimido[4,5-b][1,4]benzoxazepine, 8-bromo-4-(piperidin-1-yl)pyrimido[4,5-b][1,4]benzoxazepine
| Molecular Formula | C16H15BrN4O |
|---|---|
| Molecular Weight | 358.04 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 50.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 358.0429 |
| Heavy Atoms | 22 |
| Complexity | 415.0 |
Chemical Identifiers
| CAS Number | 84762-66-3 |
|---|---|
| SMILES | C1CCN(CC1)C2=C3C(=NC=N2)OC4=C(C=C(C=C4)Br)C=N3 |
| InChIKey | PSVJMJZHURBTDI-UHFFFAOYSA-N |
Product Overview
8-Bromo-4-piperidin-1-ylpyrimido[4,5-b][1,4]benzoxazepine (CAS 84762-66-3), with molecular formula C16H15BrN4O and molecular weight 358.04 g/mol. IUPAC: 8-bromo-4-piperidin-1-ylpyrimido[4,5-b][1,4]benzoxazepine.
Chemical Property Profile of 8-Bromo-4-piperidin-1-ylpyrimido[4,5-b][1,4]benzoxazepine
Property Insights of 8-Bromo-4-piperidin-1-ylpyrimido[4,5-b][1,4]benzoxazepine
The XLogP value of 3.9 indicates that 8-Bromo-4-piperidin-1-ylpyrimido[4,5-b][1,4]benzoxazepine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.6 Ų, 8-Bromo-4-piperidin-1-ylpyrimido[4,5-b][1,4]benzoxazepine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8-Bromo-4-piperidin-1-ylpyrimido[4,5-b][1,4]benzoxazepine 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 8-Bromo-4-piperidin-1-ylpyrimido[4,5-b][1,4]benzoxazepine?
The CAS number of 8-Bromo-4-piperidin-1-ylpyrimido[4,5-b][1,4]benzoxazepine is 84762-66-3.
What is the molecular formula of 8-Bromo-4-piperidin-1-ylpyrimido[4,5-b][1,4]benzoxazepine?
The molecular formula of 8-Bromo-4-piperidin-1-ylpyrimido[4,5-b][1,4]benzoxazepine is C16H15BrN4O.
What is the molecular weight of 8-Bromo-4-piperidin-1-ylpyrimido[4,5-b][1,4]benzoxazepine?
The molecular weight of 8-Bromo-4-piperidin-1-ylpyrimido[4,5-b][1,4]benzoxazepine is 358.04 g/mol.
Where can I buy 8-Bromo-4-piperidin-1-ylpyrimido[4,5-b][1,4]benzoxazepine?
You can request a quote for 8-Bromo-4-piperidin-1-ylpyrimido[4,5-b][1,4]benzoxazepine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-Bromo-4-piperidin-1-ylpyrimido[4,5-b][1,4]benzoxazepine?
Yes, KEHONG BIO provides custom synthesis services for 8-Bromo-4-piperidin-1-ylpyrimido[4,5-b][1,4]benzoxazepine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.