BOHLMANN K3090
TL;DR: BOHLMANN K3090 (CAS 69904-92-3) is a chemical compound with molecular formula C25H34O5 and molecular weight 414.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(4aS,6R,7R,9aR)-3,5,5,9-tetramethyl-6-[(E)-2-methylbut-2-enoyl]oxy-2-oxo-4a,6,7,9a-tetrahydro-1H-benzo[7]annulen-7-yl] (E)-2-methylbut-2-enoate
Also Known As: BOHLMANN K3090, [(4aS,6R,7R,9aR)-3,5,5,9-tetramethyl-6-[(E)-2-methylbut-2-enoyl]oxy-2-oxo-4a,6,7,9a-tetrahydro-1H-benzo[7]annulen-7-yl] (E)-2-methylbut-2-enoate, (4aS,6R,7R,9aR)-3,5,5,9-Tetramethyl-2-oxo-2,4a,5,6,7,9a-hexahydro-1H-benzo[7]annulene-6,7-diyl bis[(2E)-2-methylbut-2-enoate]
| Molecular Formula | C25H34O5 |
|---|---|
| Molecular Weight | 414.24 g/mol |
| LogP | 4.88 |
| Topological Polar Surface Area | 69.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 414.24063 |
| Heavy Atoms | 30 |
| Complexity | 852.7648 |
Chemical Identifiers
| CAS Number | 69904-92-3 |
|---|---|
| SMILES | C/C=C(\C)/C(=O)O[C@@H]1C=C([C@@H]2CC(=O)C(=C[C@@H]2C([C@H]1OC(=O)/C(=C/C)/C)(C)C)C)C |
Product Overview
BOHLMANN K3090 (CAS 69904-92-3), with molecular formula C25H34O5 and molecular weight 414.24 g/mol. IUPAC: [(4aS,6R,7R,9aR)-3,5,5,9-tetramethyl-6-[(E)-2-methylbut-2-enoyl]oxy-2-oxo-4a,6,7,9a-tetrahydro-1H-benzo[7]annulen-7-yl] (E)-2-methylbut-2-enoate.
Chemical Property Profile of BOHLMANN K3090
Property Insights of BOHLMANN K3090
The XLogP value of 4.88 indicates that BOHLMANN K3090 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.67 Ų falls within the moderate polarity range, balancing permeability and solubility for BOHLMANN K3090. Following Lipinski's Rule of Five, BOHLMANN K3090 has 0 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 K3090?
The CAS number of BOHLMANN K3090 is 69904-92-3.
What is the molecular formula of BOHLMANN K3090?
The molecular formula of BOHLMANN K3090 is C25H34O5.
What is the molecular weight of BOHLMANN K3090?
The molecular weight of BOHLMANN K3090 is 414.24 g/mol.
Where can I buy BOHLMANN K3090?
You can request a quote for BOHLMANN K3090 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BOHLMANN K3090?
Yes, KEHONG BIO provides custom synthesis services for BOHLMANN K3090 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.