RefChem:331878
TL;DR: RefChem:331878 (CAS 141312-20-1) is a chemical compound with molecular formula C22H39Cl2N3O3 and molecular weight 463.23685 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(4-ethylpiperazin-1-yl)ethyl N-(2-heptoxyphenyl)carbamate;dihydrochloride
Also Known As: Carbamic acid, (2-(heptyloxy)phenyl)-, 2-(4-ethyl-1-piperazinyl)ethyl ester, dihydrochloride, 2-(4-Ethyl-1-piperazinyl)ethyl (2-(heptyloxy)phenyl)carbamate dihydrochloride, 2-(4-ethylpiperazin-1-yl)ethyl N-(2-heptoxyphenyl)carbamate dihydrochloride, 2-(4-Ethylpiperazin-1-yl)ethyl [2-(heptyloxy)phenyl]carbamate--hydrogen chloride (1/2)
Technical Specifications
| Molecular Formula | C22H39Cl2N3O3 |
| Molecular Weight | 463.23685 g/mol |
| XLogP | 5.0654 |
| Topological Polar Surface Area (TPSA) | 54.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 13 |
| Exact Mass | 463.23685 Da |
| Heavy Atoms | 30 |
| Complexity | 414.0 |
| SMILES | CCCCCCCOC1=CC=CC=C1NC(=O)OCCN2CCN(CC2)CC.Cl.Cl |
| InChIKey | GIYSFGVWOAYVHP-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:331878
Property Insights of RefChem:331878
The XLogP value of 5.0654 indicates that RefChem:331878 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.0 Ų, RefChem:331878 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:331878 has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of RefChem:331878?
The CAS number of RefChem:331878 is 141312-20-1.
What is the molecular formula of RefChem:331878?
The molecular formula of RefChem:331878 is C22H39Cl2N3O3.
What is the molecular weight of RefChem:331878?
The molecular weight of RefChem:331878 is 463.23685 g/mol.
Where can I buy RefChem:331878?
You can request a quote for RefChem:331878 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:331878?
Yes, CoreyChem provides custom synthesis services for RefChem:331878 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.