X4BR6Mdz9G
TL;DR: X4BR6Mdz9G (CAS 315719-45-0) is a chemical compound with molecular formula C29H39N3O and molecular weight 445.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzo[b][1]benzazepin-11-yl-2-[4-[4-(diethylamino)butyl]piperidin-1-yl]ethanone
Also Known As: J1.375.664C, 5H-Dibenz(b,f)azepine, 5-((4-(4-(diethylamino)butyl)-1-piperidinyl)acetyl)-, 1-Benzo(b)(1)benzazepin-11-yl-2-(4-(4-(diethylamino)butyl)piperidin-1-yl)ethanone, 1-(2-Azatricyclo(9.4.0.0(3,8))pentadeca-1(15),3,5,7,9,11,13-heptaen-2-yl)-2-(4-(4-(diethylamino)butyl)piperidin-1-yl)ethan-1-one, 5-[[4-[4-(Diethylamino)butyl]piperidino]acetyl]-5H-dibenzo[b,f]azepine
| Molecular Formula | C29H39N3O |
|---|---|
| Molecular Weight | 445.31 g/mol |
| LogP | 6.0592 |
| Topological Polar Surface Area | 26.79 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 9 |
| Exact Mass | 445.30933 |
| Heavy Atoms | 33 |
| Complexity | 891.8881 |
Chemical Identifiers
| CAS Number | 315719-45-0 |
|---|---|
| SMILES | CCN(CC)CCCCC1CCN(CC1)CC(=O)N2C3=CC=CC=C3C=CC4=CC=CC=C42 |
Product Overview
X4BR6Mdz9G (CAS 315719-45-0), with molecular formula C29H39N3O and molecular weight 445.31 g/mol. IUPAC: 1-benzo[b][1]benzazepin-11-yl-2-[4-[4-(diethylamino)butyl]piperidin-1-yl]ethanone.
Chemical Property Profile of X4BR6Mdz9G
Property Insights of X4BR6Mdz9G
The XLogP value of 6.0592 indicates that X4BR6Mdz9G is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.79 Ų, X4BR6Mdz9G exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, X4BR6Mdz9G has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of X4BR6Mdz9G?
The CAS number of X4BR6Mdz9G is 315719-45-0.
What is the molecular formula of X4BR6Mdz9G?
The molecular formula of X4BR6Mdz9G is C29H39N3O.
What is the molecular weight of X4BR6Mdz9G?
The molecular weight of X4BR6Mdz9G is 445.31 g/mol.
Where can I buy X4BR6Mdz9G?
You can request a quote for X4BR6Mdz9G directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for X4BR6Mdz9G?
Yes, KEHONG BIO provides custom synthesis services for X4BR6Mdz9G and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.