RefChem:1060141
TL;DR: RefChem:1060141 (CAS 59177-82-1) is a chemical compound with molecular formula C20H32N2O5 and molecular weight 380.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-but-2-enedioic acid;7-[(4-methylpiperazin-1-yl)methyl]tricyclo[4.3.1.03,8]decan-7-ol
Also Known As: 2,5-Methanoindan-4-ol, hexahydro-4-(4-methyl-1-piperazinyl)methyl-, dihydrochloride, 4-(4-Methyl-1-piperazinyl)methylprotoadamantan-4-ol, dihydrochloride, 2,5-Methano-1H-inden-4-ol, octahydro-4-[(4-methyl-1-piperazinyl)methyl]-, dihydrochloride, RefChem:1060141
| Molecular Formula | C20H32N2O5 |
|---|---|
| Molecular Weight | 380.23 g/mol |
| LogP | 1.1328 |
| Topological Polar Surface Area | 101.31 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 380.2311 |
| Heavy Atoms | 27 |
| Complexity | 570.92114 |
Chemical Identifiers
| CAS Number | 59177-82-1 |
|---|---|
| SMILES | CN1CCN(CC1)CC2(C3CCC4C2CC(C4)C3)O.C(=C\C(=O)O)\C(=O)O |
Product Overview
RefChem:1060141 (CAS 59177-82-1), with molecular formula C20H32N2O5 and molecular weight 380.23 g/mol. IUPAC: (Z)-but-2-enedioic acid;7-[(4-methylpiperazin-1-yl)methyl]tricyclo[4.3.1.03,8]decan-7-ol.
Chemical Property Profile of RefChem:1060141
Property Insights of RefChem:1060141
The XLogP value of 1.1328 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1060141. The TPSA of 101.31 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1060141. Following Lipinski's Rule of Five, RefChem:1060141 has 3 hydrogen bond donor(s) and 5 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:1060141?
The CAS number of RefChem:1060141 is 59177-82-1.
What is the molecular formula of RefChem:1060141?
The molecular formula of RefChem:1060141 is C20H32N2O5.
What is the molecular weight of RefChem:1060141?
The molecular weight of RefChem:1060141 is 380.23 g/mol.
Where can I buy RefChem:1060141?
You can request a quote for RefChem:1060141 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1060141?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1060141 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.