ChemDiv1_020939
TL;DR: ChemDiv1_020939 (CAS 330216-16-5) is a chemical compound with molecular formula C22H25N3O4 and molecular weight 395.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl N-[11-(morpholine-4-carbonyl)-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamate
Also Known As: ChemDiv1_020939, BAS 01947503, BIM-0006215.P001, ethyl (5-(morpholine-4-carbonyl)-10,11-dihydro-5H-dibenzo[b,f]azepin-3-yl)carbamate, ethoxy-N-[5-(morpholin-4-ylcarbonyl)(10H,11H-dibenzo[b,f]azepin-3-yl)]carboxam ide
| Molecular Formula | C22H25N3O4 |
|---|---|
| Molecular Weight | 395.18 g/mol |
| LogP | 3.9439 |
| Topological Polar Surface Area | 71.11 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 395.1845 |
| Heavy Atoms | 29 |
| Complexity | 908.6804 |
Chemical Identifiers
| CAS Number | 330216-16-5 |
|---|---|
| SMILES | CCOC(=O)NC1=CC2=C(CCC3=CC=CC=C3N2C(=O)N4CCOCC4)C=C1 |
Product Overview
ChemDiv1_020939 (CAS 330216-16-5), with molecular formula C22H25N3O4 and molecular weight 395.18 g/mol. IUPAC: ethyl N-[11-(morpholine-4-carbonyl)-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamate.
Chemical Property Profile of ChemDiv1_020939
Property Insights of ChemDiv1_020939
The XLogP value of 3.9439 indicates that ChemDiv1_020939 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.11 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_020939. Following Lipinski's Rule of Five, ChemDiv1_020939 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 ChemDiv1_020939?
The CAS number of ChemDiv1_020939 is 330216-16-5.
What is the molecular formula of ChemDiv1_020939?
The molecular formula of ChemDiv1_020939 is C22H25N3O4.
What is the molecular weight of ChemDiv1_020939?
The molecular weight of ChemDiv1_020939 is 395.18 g/mol.
Where can I buy ChemDiv1_020939?
You can request a quote for ChemDiv1_020939 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_020939?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_020939 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.