RefChem:332152
TL;DR: RefChem:332152 (CAS 134068-41-0) is a chemical compound with molecular formula C22H28ClN3O3 and molecular weight 417.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl N-[11-[2-(ethylamino)acetyl]-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamate;hydrochloride
Also Known As: Carbamic acid, (5-((ethylamino)acetyl)-10,11-dihydro-5H-dibenz(b,f)azepin-3-yl)-, 1-methylethyl ester, monohydrochloride, Isopropyl (5-((ethylamino)acetyl)-10,11-dihydro-5H-dibenz(b,f)azepin-3-yl)carbamate HCl, 3-Carbisopropoxyamino-5-ethylaminoacetyl-10,11-dihydro-5H-dibenz(b,f)azepine hydrochloride, [5-(2-Ethylamino-acetyl)-10,11-dihydro-5H-dibenzo[b,f]azepin-3-yl]-carbamic acid isopropyl ester, Propan-2-yl [5-(N-ethylglycyl)-10,11-dihydro-5H-dibenzo[b,f]azepin-3-yl]carbamate--hydrogen chloride (1/1)
| Molecular Formula | C22H28ClN3O3 |
|---|---|
| Molecular Weight | 417.18 g/mol |
| LogP | 4.4381 |
| Topological Polar Surface Area | 70.67 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 417.18192 |
| Heavy Atoms | 29 |
| Complexity | 870.13104 |
Chemical Identifiers
| CAS Number | 134068-41-0 |
|---|---|
| SMILES | CCNCC(=O)N1C2=CC=CC=C2CCC3=C1C=C(C=C3)NC(=O)OC(C)C.Cl |
Product Overview
RefChem:332152 (CAS 134068-41-0), with molecular formula C22H28ClN3O3 and molecular weight 417.18 g/mol. IUPAC: propan-2-yl N-[11-[2-(ethylamino)acetyl]-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamate;hydrochloride.
Chemical Property Profile of RefChem:332152
Property Insights of RefChem:332152
The XLogP value of 4.4381 indicates that RefChem:332152 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.67 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:332152. Following Lipinski's Rule of Five, RefChem:332152 has 2 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 RefChem:332152?
The CAS number of RefChem:332152 is 134068-41-0.
What is the molecular formula of RefChem:332152?
The molecular formula of RefChem:332152 is C22H28ClN3O3.
What is the molecular weight of RefChem:332152?
The molecular weight of RefChem:332152 is 417.18 g/mol.
Where can I buy RefChem:332152?
You can request a quote for RefChem:332152 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:332152?
Yes, KEHONG BIO provides custom synthesis services for RefChem:332152 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.