3-Carbisopropoxyamino-5-(beta-oxyethylamino)acetyl-10,11-dihydro-5H-dibenz(b,f)azepine HCl
TL;DR: 3-Carbisopropoxyamino-5-(beta-oxyethylamino)acetyl-10,11-dihydro-5H-dibenz(b,f)azepine HCl (CAS 134068-40-9) is a chemical compound with molecular formula C22H28ClN3O4 and molecular weight 433.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl N-[11-[2-(2-hydroxyethylamino)acetyl]-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamate;hydrochloride
Also Known As: 3-Carbisopropoxyamino-5-(beta-oxyethylamino)acetyl-10,11-dihydro-5H-dibenz(b,f)azepine HCl, Carbamic acid, (10,11-dihydro-5-(((2-hydroxyethyl)amino)acetyl)-5H-dibenz(b,f)azepin-3-yl)-, 1-methylethyl ester, monohydrochloride, propan-2-yl N-[11-[2-(2-hydroxyethylamino)acetyl]-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamate;hydrochloride, isopropyl (5-(2-((2-hydroxyethyl)amino)acetyl)-10,11-dihydro-5H-dibenzo[b,f]azepin-3-yl)carbamate hydrochloride, Propan-2-yl {5-[N-(2-hydroxyethyl)glycyl]-10,11-dihydro-5H-dibenzo[b,f]azepin-3-yl}carbamate--hydrogen chloride (1/1)
| Molecular Formula | C22H28ClN3O4 |
|---|---|
| Molecular Weight | 433.18 g/mol |
| LogP | 3.4105 |
| Topological Polar Surface Area | 90.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 433.17682 |
| Heavy Atoms | 30 |
| Complexity | 888.4364 |
Chemical Identifiers
| CAS Number | 134068-40-9 |
|---|---|
| SMILES | CC(C)OC(=O)NC1=CC2=C(CCC3=CC=CC=C3N2C(=O)CNCCO)C=C1.Cl |
Product Overview
3-Carbisopropoxyamino-5-(beta-oxyethylamino)acetyl-10,11-dihydro-5H-dibenz(b,f)azepine HCl (CAS 134068-40-9), with molecular formula C22H28ClN3O4 and molecular weight 433.18 g/mol. IUPAC: propan-2-yl N-[11-[2-(2-hydroxyethylamino)acetyl]-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamate;hydrochloride.
Chemical Property Profile of 3-Carbisopropoxyamino-5-(beta-oxyethylamino)acetyl-10,11-dihydro-5H-dibenz(b,f)azepine HCl
Property Insights of 3-Carbisopropoxyamino-5-(beta-oxyethylamino)acetyl-10,11-dihydro-5H-dibenz(b,f)azepine HCl
The XLogP value of 3.4105 indicates that 3-Carbisopropoxyamino-5-(beta-oxyethylamino)acetyl-10,11-dihydro-5H-dibenz(b,f)azepine HCl is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Carbisopropoxyamino-5-(beta-oxyethylamino)acetyl-10,11-dihydro-5H-dibenz(b,f)azepine HCl. Following Lipinski's Rule of Five, 3-Carbisopropoxyamino-5-(beta-oxyethylamino)acetyl-10,11-dihydro-5H-dibenz(b,f)azepine HCl has 3 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 3-Carbisopropoxyamino-5-(beta-oxyethylamino)acetyl-10,11-dihydro-5H-dibenz(b,f)azepine HCl?
The CAS number of 3-Carbisopropoxyamino-5-(beta-oxyethylamino)acetyl-10,11-dihydro-5H-dibenz(b,f)azepine HCl is 134068-40-9.
What is the molecular formula of 3-Carbisopropoxyamino-5-(beta-oxyethylamino)acetyl-10,11-dihydro-5H-dibenz(b,f)azepine HCl?
The molecular formula of 3-Carbisopropoxyamino-5-(beta-oxyethylamino)acetyl-10,11-dihydro-5H-dibenz(b,f)azepine HCl is C22H28ClN3O4.
What is the molecular weight of 3-Carbisopropoxyamino-5-(beta-oxyethylamino)acetyl-10,11-dihydro-5H-dibenz(b,f)azepine HCl?
The molecular weight of 3-Carbisopropoxyamino-5-(beta-oxyethylamino)acetyl-10,11-dihydro-5H-dibenz(b,f)azepine HCl is 433.18 g/mol.
Where can I buy 3-Carbisopropoxyamino-5-(beta-oxyethylamino)acetyl-10,11-dihydro-5H-dibenz(b,f)azepine HCl?
You can request a quote for 3-Carbisopropoxyamino-5-(beta-oxyethylamino)acetyl-10,11-dihydro-5H-dibenz(b,f)azepine HCl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Carbisopropoxyamino-5-(beta-oxyethylamino)acetyl-10,11-dihydro-5H-dibenz(b,f)azepine HCl?
Yes, KEHONG BIO provides custom synthesis services for 3-Carbisopropoxyamino-5-(beta-oxyethylamino)acetyl-10,11-dihydro-5H-dibenz(b,f)azepine HCl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.