![ethyl (5-(2-(diethylamino)acetyl)-5H-dibenzo[b,f]azepin-3-yl)carbamate hydrochloride hydrate structure](/static/products/464/464877-01-8.png)
ethyl (5-(2-(diethylamino)acetyl)-5H-dibenzo[b,f]azepin-3-yl)carbamate hydrochloride hydrate
TL;DR: ethyl (5-(2-(diethylamino)acetyl)-5H-dibenzo[b,f]azepin-3-yl)carbamate hydrochloride hydrate (CAS 464877-01-8) is a chemical compound with molecular formula C23H30ClN3O4 and molecular weight 447.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl N-[11-[2-(diethylamino)acetyl]benzo[b][1]benzazepin-2-yl]carbamate;hydrate;hydrochloride
Also Known As: ethyl (5-(2-(diethylamino)acetyl)-5H-dibenzo[b,f]azepin-3-yl)carbamate hydrochloride hydrate, ethyl N-[11-[2-(diethylamino)acetyl]benzo[b][1]benzazepin-2-yl]carbamate hydrate hydrochloride, REGID_for_CID_6602780
| Molecular Formula | C23H30ClN3O4 |
|---|---|
| Molecular Weight | 447.19 g/mol |
| LogP | 4.3424 |
| Topological Polar Surface Area | 93.38 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 447.19247 |
| Heavy Atoms | 31 |
| Complexity | 928.78766 |
Chemical Identifiers
| CAS Number | 464877-01-8 |
|---|---|
| SMILES | CCN(CC)CC(=O)N1C2=CC=CC=C2C=CC3=C1C=C(C=C3)NC(=O)OCC.O.Cl |
Product Overview
ethyl (5-(2-(diethylamino)acetyl)-5H-dibenzo[b,f]azepin-3-yl)carbamate hydrochloride hydrate (CAS 464877-01-8), with molecular formula C23H30ClN3O4 and molecular weight 447.19 g/mol. IUPAC: ethyl N-[11-[2-(diethylamino)acetyl]benzo[b][1]benzazepin-2-yl]carbamate;hydrate;hydrochloride.
Chemical Property Profile of ethyl (5-(2-(diethylamino)acetyl)-5H-dibenzo[b,f]azepin-3-yl)carbamate hydrochloride hydrate
Property Insights of ethyl (5-(2-(diethylamino)acetyl)-5H-dibenzo[b,f]azepin-3-yl)carbamate hydrochloride hydrate
The XLogP value of 4.3424 indicates that ethyl (5-(2-(diethylamino)acetyl)-5H-dibenzo[b,f]azepin-3-yl)carbamate hydrochloride hydrate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.38 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl (5-(2-(diethylamino)acetyl)-5H-dibenzo[b,f]azepin-3-yl)carbamate hydrochloride hydrate. Following Lipinski's Rule of Five, ethyl (5-(2-(diethylamino)acetyl)-5H-dibenzo[b,f]azepin-3-yl)carbamate hydrochloride hydrate 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 ethyl (5-(2-(diethylamino)acetyl)-5H-dibenzo[b,f]azepin-3-yl)carbamate hydrochloride hydrate?
The CAS number of ethyl (5-(2-(diethylamino)acetyl)-5H-dibenzo[b,f]azepin-3-yl)carbamate hydrochloride hydrate is 464877-01-8.
What is the molecular formula of ethyl (5-(2-(diethylamino)acetyl)-5H-dibenzo[b,f]azepin-3-yl)carbamate hydrochloride hydrate?
The molecular formula of ethyl (5-(2-(diethylamino)acetyl)-5H-dibenzo[b,f]azepin-3-yl)carbamate hydrochloride hydrate is C23H30ClN3O4.
What is the molecular weight of ethyl (5-(2-(diethylamino)acetyl)-5H-dibenzo[b,f]azepin-3-yl)carbamate hydrochloride hydrate?
The molecular weight of ethyl (5-(2-(diethylamino)acetyl)-5H-dibenzo[b,f]azepin-3-yl)carbamate hydrochloride hydrate is 447.19 g/mol.
Where can I buy ethyl (5-(2-(diethylamino)acetyl)-5H-dibenzo[b,f]azepin-3-yl)carbamate hydrochloride hydrate?
You can request a quote for ethyl (5-(2-(diethylamino)acetyl)-5H-dibenzo[b,f]azepin-3-yl)carbamate hydrochloride hydrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl (5-(2-(diethylamino)acetyl)-5H-dibenzo[b,f]azepin-3-yl)carbamate hydrochloride hydrate?
Yes, KEHONG BIO provides custom synthesis services for ethyl (5-(2-(diethylamino)acetyl)-5H-dibenzo[b,f]azepin-3-yl)carbamate hydrochloride hydrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.