C19H28N2O.2ClH.1/2H2O
TL;DR: C19H28N2O.2ClH.1/2H2O (CAS 67367-91-3) is a chemical compound with molecular formula C19H30Cl2N2O and molecular weight 372.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-2-(4-methylpiperazin-1-yl)ethanol;dihydrochloride
Also Known As: C19H28N2O.2ClH.1/2H2O, C19-H28-N2-O.2Cl-H.1/2H2-O, alpha-(1,2,3,5,6,7-Hexahydro-s-indacen-4-yl)-4-methyl-1-piperazineethanol 2HCl hemihydrate, 1-Piperazineethanol, alpha-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-4-methyl-, hydrochloride, hydrate (2:4:1), 1-(1,2,3,5,6,7-Hexahydro-s-indacen-4-yl)-2-(4-methylpiperazin-1-yl)ethan-1-ol--hydrogen chloride (1/2)
| Molecular Formula | C19H30Cl2N2O |
|---|---|
| Molecular Weight | 372.17 g/mol |
| LogP | 2.7884 |
| Topological Polar Surface Area | 26.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 372.17352 |
| Heavy Atoms | 24 |
| Complexity | 538.72546 |
Chemical Identifiers
| CAS Number | 67367-91-3 |
|---|---|
| SMILES | CN1CCN(CC1)CC(C2=C3CCCC3=CC4=C2CCC4)O.Cl.Cl |
Product Overview
C19H28N2O.2ClH.1/2H2O (CAS 67367-91-3), with molecular formula C19H30Cl2N2O and molecular weight 372.17 g/mol. IUPAC: 1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-2-(4-methylpiperazin-1-yl)ethanol;dihydrochloride.
Chemical Property Profile of C19H28N2O.2ClH.1/2H2O
Property Insights of C19H28N2O.2ClH.1/2H2O
The XLogP value of 2.7884 suggests moderate lipophilicity, balancing water solubility and membrane permeability for C19H28N2O.2ClH.1/2H2O. With a topological polar surface area (TPSA) of 26.71 Ų, C19H28N2O.2ClH.1/2H2O exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, C19H28N2O.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 C19H28N2O.2ClH.1/2H2O?
The CAS number of C19H28N2O.2ClH.1/2H2O is 67367-91-3.
What is the molecular formula of C19H28N2O.2ClH.1/2H2O?
The molecular formula of C19H28N2O.2ClH.1/2H2O is C19H30Cl2N2O.
What is the molecular weight of C19H28N2O.2ClH.1/2H2O?
The molecular weight of C19H28N2O.2ClH.1/2H2O is 372.17 g/mol.
Where can I buy C19H28N2O.2ClH.1/2H2O?
You can request a quote for C19H28N2O.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 C19H28N2O.2ClH.1/2H2O?
Yes, KEHONG BIO provides custom synthesis services for C19H28N2O.2ClH.1/2H2O and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.