1-beta-Diethylaminoethyl-4-acetylaceperimidine dihydrochloride
TL;DR: 1-beta-Diethylaminoethyl-4-acetylaceperimidine dihydrochloride (CAS 62522-53-6) is a chemical compound with molecular formula C21H25Cl2N3O and molecular weight 405.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[7-[2-(diethylamino)ethyl]-5,7-diazatetracyclo[6.5.2.04,15.011,14]pentadeca-1,3,5,8(15),9,11(14),12-heptaen-3-yl]ethanone;dihydrochloride
Also Known As: 1-beta-Diethylaminoethyl-4-acetylaceperimidine dihydrochloride, 1H-Cyclopenta(gh)perimidine, 6,7-dihydro-4-acetyl-1-(2-(diethylamino)ethyl)-, dihydrochloride, 6,7-Dihydro-4-acetyl-1-(2-(diethylamino)ethyl)-1H-cyclopenta(gh)perimidine dihydrochloride, 1-{1-[2-(Diethylamino)ethyl]-1H-cyclopenta[gh]perimidin-4-yl}ethan-1-one--hydrogen chloride (1/2), RefChem:237765
| Molecular Formula | C21H25Cl2N3O |
|---|---|
| Molecular Weight | 405.14 g/mol |
| LogP | 5.1685 |
| Topological Polar Surface Area | 38.13 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 405.13748 |
| Heavy Atoms | 27 |
| Complexity | 1069.5479 |
Chemical Identifiers
| CAS Number | 62522-53-6 |
|---|---|
| SMILES | CCN(CC)CCN1C=NC2=C(C=C3C=CC4=C3C2=C1C=C4)C(=O)C.Cl.Cl |
Product Overview
1-beta-Diethylaminoethyl-4-acetylaceperimidine dihydrochloride (CAS 62522-53-6), with molecular formula C21H25Cl2N3O and molecular weight 405.14 g/mol. IUPAC: 1-[7-[2-(diethylamino)ethyl]-5,7-diazatetracyclo[6.5.2.04,15.011,14]pentadeca-1,3,5,8(15),9,11(14),12-heptaen-3-yl]ethanone;dihydrochloride.
Chemical Property Profile of 1-beta-Diethylaminoethyl-4-acetylaceperimidine dihydrochloride
Property Insights of 1-beta-Diethylaminoethyl-4-acetylaceperimidine dihydrochloride
The XLogP value of 5.1685 indicates that 1-beta-Diethylaminoethyl-4-acetylaceperimidine dihydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.13 Ų, 1-beta-Diethylaminoethyl-4-acetylaceperimidine dihydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-beta-Diethylaminoethyl-4-acetylaceperimidine dihydrochloride has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-beta-Diethylaminoethyl-4-acetylaceperimidine dihydrochloride?
The CAS number of 1-beta-Diethylaminoethyl-4-acetylaceperimidine dihydrochloride is 62522-53-6.
What is the molecular formula of 1-beta-Diethylaminoethyl-4-acetylaceperimidine dihydrochloride?
The molecular formula of 1-beta-Diethylaminoethyl-4-acetylaceperimidine dihydrochloride is C21H25Cl2N3O.
What is the molecular weight of 1-beta-Diethylaminoethyl-4-acetylaceperimidine dihydrochloride?
The molecular weight of 1-beta-Diethylaminoethyl-4-acetylaceperimidine dihydrochloride is 405.14 g/mol.
Where can I buy 1-beta-Diethylaminoethyl-4-acetylaceperimidine dihydrochloride?
You can request a quote for 1-beta-Diethylaminoethyl-4-acetylaceperimidine dihydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-beta-Diethylaminoethyl-4-acetylaceperimidine dihydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 1-beta-Diethylaminoethyl-4-acetylaceperimidine dihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.