Dienomycin A hydrochloride
TL;DR: Dienomycin A hydrochloride (CAS 26834-29-7) is a chemical compound with molecular formula C20H28ClNO2 and molecular weight 349.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2R,3R,4S)-3-methyl-2-[(1E,3E)-4-phenylbuta-1,3-dienyl]piperidin-1-ium-4-yl] 2-methylpropanoate chloride
Also Known As: Dienomycin A hydrochloride, 4-Isobutyryloxy-3-methyl-2-(4-phenylbutadienyl)piperidine hydrochloride, Isobutyric acid, 3-methyl-2-(4-phenyl-1,3-butadienyl)-4-piperidyl ester, hydrochloride, (E,E)-trans-2,3-trans-2,4-, [(2R,3R,4S)-3-methyl-2-[(1E,3E)-4-phenylbuta-1,3-dienyl]piperidin-1-ium-4-yl] 2-methylpropanoate chloride, RefChem:1087520
| Molecular Formula | C20H28ClNO2 |
|---|---|
| Molecular Weight | 349.18 g/mol |
| LogP | -0.2004 |
| Topological Polar Surface Area | 42.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 349.18085 |
| Heavy Atoms | 24 |
| Complexity | 554.0171 |
Chemical Identifiers
| CAS Number | 26834-29-7 |
|---|---|
| SMILES | C[C@H]1[C@H](CC[NH2+][C@@H]1/C=C/C=C/C2=CC=CC=C2)OC(=O)C(C)C.[Cl-] |
Product Overview
Dienomycin A hydrochloride (CAS 26834-29-7), with molecular formula C20H28ClNO2 and molecular weight 349.18 g/mol. IUPAC: [(2R,3R,4S)-3-methyl-2-[(1E,3E)-4-phenylbuta-1,3-dienyl]piperidin-1-ium-4-yl] 2-methylpropanoate chloride.
Chemical Property Profile of Dienomycin A hydrochloride
Property Insights of Dienomycin A hydrochloride
The XLogP value of -0.2004 indicates that Dienomycin A hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 42.91 Ų, Dienomycin A hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dienomycin A hydrochloride has 1 hydrogen bond donor(s) and 2 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 Dienomycin A hydrochloride?
The CAS number of Dienomycin A hydrochloride is 26834-29-7.
What is the molecular formula of Dienomycin A hydrochloride?
The molecular formula of Dienomycin A hydrochloride is C20H28ClNO2.
What is the molecular weight of Dienomycin A hydrochloride?
The molecular weight of Dienomycin A hydrochloride is 349.18 g/mol.
Where can I buy Dienomycin A hydrochloride?
You can request a quote for Dienomycin A hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dienomycin A hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Dienomycin A hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.