Bohlmann K1922
TL;DR: Bohlmann K1922 (CAS 55050-48-1) is a chemical compound with molecular formula C19H26O5 and molecular weight 334.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(8-hydroxy-3,4a,5-trimethyl-9-oxo-4,5,6,7,8,8a-hexahydrobenzo[f][1]benzofuran-4-yl) 2-methylpropanoate
Also Known As: BOHLMANN K1922, NCI60_002547, (8-hydroxy-3,4a,5-trimethyl-9-oxo-4,5,6,7,8,8a-hexahydrobenzo[f][1]benzofuran-4-yl) 2-methylpropanoate, (8-hydroxy-3,4a,5-trimethyl-9-oxo-4,5,6,7,8,8a-hexahydrobenzo[f]benzofuran-4-yl) 2-methylpropanoate, [(4S,4aR,5S,8S,8aR)-8-hydroxy-3,4a,5-trimethyl-9-oxo-4,5,6,7,8,8a-hexahydrobenzo[f][1]benzofuran-4-yl] 2-methylpropanoate
| Molecular Formula | C19H26O5 |
|---|---|
| Molecular Weight | 334.18 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 76.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 334.178 |
| Heavy Atoms | 24 |
| Complexity | 530.0 |
Chemical Identifiers
| CAS Number | 55050-48-1 |
|---|---|
| SMILES | CC1CCC(C2C1(C(C3=C(C2=O)OC=C3C)OC(=O)C(C)C)C)O |
| InChIKey | AXTBBOHGQOEWMH-UHFFFAOYSA-N |
Product Overview
Bohlmann K1922 (CAS 55050-48-1), with molecular formula C19H26O5 and molecular weight 334.18 g/mol. IUPAC: (8-hydroxy-3,4a,5-trimethyl-9-oxo-4,5,6,7,8,8a-hexahydrobenzo[f][1]benzofuran-4-yl) 2-methylpropanoate.
Chemical Property Profile of Bohlmann K1922
Property Insights of Bohlmann K1922
The XLogP value of 3.3 indicates that Bohlmann K1922 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Bohlmann K1922. Following Lipinski's Rule of Five, Bohlmann K1922 has 1 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 Bohlmann K1922?
The CAS number of Bohlmann K1922 is 55050-48-1.
What is the molecular formula of Bohlmann K1922?
The molecular formula of Bohlmann K1922 is C19H26O5.
What is the molecular weight of Bohlmann K1922?
The molecular weight of Bohlmann K1922 is 334.18 g/mol.
Where can I buy Bohlmann K1922?
You can request a quote for Bohlmann K1922 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bohlmann K1922?
Yes, KEHONG BIO provides custom synthesis services for Bohlmann K1922 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.