Pachydictyol A
TL;DR: Pachydictyol A (CAS 50299-47-3) is a chemical compound with molecular formula C20H32O and molecular weight 288.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3aS,4R,5S,8aR)-3-methyl-5-[(2R)-6-methylhept-5-en-2-yl]-8-methylidene-3a,4,5,6,7,8a-hexahydro-1H-azulen-4-ol
Also Known As: Pachydictyol A, (3aS,4R,5S,8aR)-3-methyl-5-[(2R)-6-methylhept-5-en-2-yl]-8-methylidene-3a,4,5,6,7,8a-hexahydro-1H-azulen-4-ol, 4-Azulenol, 5-(1,5-dimethyl-4-hexenyl)-1,3a,4,5,6,7,8,8a-octahydro-3-methyl-8-methylene-, (3aS-(3aalpha,4alpha,5alpha(S*),8abeta))-, (3aS,4R,5S,8aR)-3-methyl-5-[(2R)-6-methylhept-5-en-2-yl]-8-methylidene-1,3a,4,5,6,7,8,8a-octahydroazulen-4-ol, (3aS)-3-Methyl-5alpha-[(R)-1,5-dimethyl-4-hexenyl]-8-methylene-1,3aalpha,4,5,6,7,8,8abeta-octahydroazulene-4alpha-ol
| Molecular Formula | C20H32O |
|---|---|
| Molecular Weight | 288.25 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 288.24533 |
| Heavy Atoms | 21 |
| Complexity | 439.0 |
Chemical Identifiers
| CAS Number | 50299-47-3 |
|---|---|
| SMILES | CC1=CC[C@@H]2[C@@H]1[C@@H]([C@@H](CCC2=C)[C@H](C)CCC=C(C)C)O |
| InChIKey | KFIZBQZEEKZCAT-RBUQIHAASA-N |
Product Overview
Pachydictyol A (CAS 50299-47-3), with molecular formula C20H32O and molecular weight 288.25 g/mol. IUPAC: (3aS,4R,5S,8aR)-3-methyl-5-[(2R)-6-methylhept-5-en-2-yl]-8-methylidene-3a,4,5,6,7,8a-hexahydro-1H-azulen-4-ol.
Chemical Property Profile of Pachydictyol A
Property Insights of Pachydictyol A
The XLogP value of 4.9 indicates that Pachydictyol A is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, Pachydictyol A exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pachydictyol A has 1 hydrogen bond donor(s) and 1 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 Pachydictyol A?
The CAS number of Pachydictyol A is 50299-47-3.
What is the molecular formula of Pachydictyol A?
The molecular formula of Pachydictyol A is C20H32O.
What is the molecular weight of Pachydictyol A?
The molecular weight of Pachydictyol A is 288.25 g/mol.
Where can I buy Pachydictyol A?
You can request a quote for Pachydictyol A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pachydictyol A?
Yes, KEHONG BIO provides custom synthesis services for Pachydictyol A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.