C20H30N2O.2ClH.1/2H2O
TL;DR: C20H30N2O.2ClH.1/2H2O (CAS 82875-66-9) is a chemical compound with molecular formula C20H32Cl2N2O and molecular weight 386.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-[2-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)ethyl]piperazin-1-yl]ethanol;dihydrochloride
Also Known As: C20H30N2O.2ClH.1/2H2O, 1-Piperazineethanol, 4-(2-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)ethyl)-, hydrochloride, hydrate (2:4:1), C20-H30-N2-O.2Cl-H.1/2H2-O, 1-(2-(s-Hydrindacen-4-yl)ethyl)-4-(2-hydroxyethyl)piperazine dihydrochloride hemihydrate, 2-[4-[2-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)ethyl]piperazi
| Molecular Formula | C20H32Cl2N2O |
|---|---|
| Molecular Weight | 386.19 g/mol |
| LogP | 2.66 |
| Topological Polar Surface Area | 26.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 386.18918 |
| Heavy Atoms | 25 |
| Complexity | 539.0549 |
Chemical Identifiers
| CAS Number | 82875-66-9 |
|---|---|
| SMILES | C1CC2=CC3=C(CCC3)C(=C2C1)CCN4CCN(CC4)CCO.Cl.Cl |
Product Overview
C20H30N2O.2ClH.1/2H2O (CAS 82875-66-9), with molecular formula C20H32Cl2N2O and molecular weight 386.19 g/mol. IUPAC: 2-[4-[2-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)ethyl]piperazin-1-yl]ethanol;dihydrochloride.
Chemical Property Profile of C20H30N2O.2ClH.1/2H2O
Property Insights of C20H30N2O.2ClH.1/2H2O
The XLogP value of 2.66 suggests moderate lipophilicity, balancing water solubility and membrane permeability for C20H30N2O.2ClH.1/2H2O. With a topological polar surface area (TPSA) of 26.71 Ų, C20H30N2O.2ClH.1/2H2O exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, C20H30N2O.2ClH.1/2H2O has 1 hydrogen bond donor(s) and 3 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 C20H30N2O.2ClH.1/2H2O?
The CAS number of C20H30N2O.2ClH.1/2H2O is 82875-66-9.
What is the molecular formula of C20H30N2O.2ClH.1/2H2O?
The molecular formula of C20H30N2O.2ClH.1/2H2O is C20H32Cl2N2O.
What is the molecular weight of C20H30N2O.2ClH.1/2H2O?
The molecular weight of C20H30N2O.2ClH.1/2H2O is 386.19 g/mol.
Where can I buy C20H30N2O.2ClH.1/2H2O?
You can request a quote for C20H30N2O.2ClH.1/2H2O directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C20H30N2O.2ClH.1/2H2O?
Yes, KEHONG BIO provides custom synthesis services for C20H30N2O.2ClH.1/2H2O and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.