RefChem:350388
TL;DR: RefChem:350388 (CAS 29573-86-2) is a chemical compound with molecular formula C22H29Cl2N3O2 and molecular weight 437.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-2-[4-(2-hydroxyethyl)piperazin-1-yl]ethanone;dihydrochloride
Also Known As: Ketone, 10,11-dihydro-5H-dibenz(b,f)azepin-5-yl (4-(2-hydroxyethyl)piperazinyl)methyl, dihydrochloride, 1-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-2-[4-(2-hydroxyethyl)piperazin-1-yl]ethanone dihydrochloride, KETONE, 10,11-DIHYDRO-5H-DIBENZ(b,f)AZEPIN-5-YL (4-(2-HYDROXYETHYL)PIPERAZINYL)M, 1-(10,11-Dihydro-5H-dibenzo[b,f]azepin-5-yl)-2-[4-(2-hydroxyethyl)piperazin-1-yl]ethan-1-one--hydrogen chloride (1/2), 5H-Dibenz[b,f]azepine, 10,11-dihydro-5-[[4-(2-hydroxyethyl)-1-piperazinyl]acetyl]-, dihydrochloride
| Molecular Formula | C22H29Cl2N3O2 |
|---|---|
| Molecular Weight | 437.16 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 47.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 437.1637 |
| Heavy Atoms | 29 |
| Complexity | 468.0 |
Chemical Identifiers
| CAS Number | 29573-86-2 |
|---|---|
| SMILES | C1CC2=CC=CC=C2N(C3=CC=CC=C31)C(=O)CN4CCN(CC4)CCO.Cl.Cl |
| InChIKey | TZGOOZDYIXRJPG-UHFFFAOYSA-N |
Product Overview
RefChem:350388 (CAS 29573-86-2), with molecular formula C22H29Cl2N3O2 and molecular weight 437.16 g/mol. IUPAC: 1-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-2-[4-(2-hydroxyethyl)piperazin-1-yl]ethanone;dihydrochloride.
Chemical Property Profile of RefChem:350388
Property Insights of RefChem:350388
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:350388. With a topological polar surface area (TPSA) of 47.0 Ų, RefChem:350388 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:350388 has 3 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:350388?
The CAS number of RefChem:350388 is 29573-86-2.
What is the molecular formula of RefChem:350388?
The molecular formula of RefChem:350388 is C22H29Cl2N3O2.
What is the molecular weight of RefChem:350388?
The molecular weight of RefChem:350388 is 437.16 g/mol.
Where can I buy RefChem:350388?
You can request a quote for RefChem:350388 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:350388?
Yes, KEHONG BIO provides custom synthesis services for RefChem:350388 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.